Adrenoceptors

Cas#: 106266-06-2        Compound CID:  5073

Formula:  C₂₃H₂₇FN₄O₂        Molecular Weight: 410.48

IUPAC Name: 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

SMILES: CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

InChIKey: RAPZEAPATHNIPO-UHFFFAOYSA-N

InChI: InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3

Cas#: 18016-80-3        Compound CID:  28864

Formula:  C₂₀H₂₆N₄O        Molecular Weight: 338.45

IUPAC Name: 3-[(6aR,9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]-1,1-diethylurea

SMILES: CCN(CC)C(=O)NC1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C

InChIKey: BKRGVLQUQGGVSM-KBXCAEBGSA-N

InChI: InChI=1S/C20H26N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,10-11,14,18,21H,4-5,9,12H2,1-3H3,(H,22,25)/t14-,18+/m0/s1

Cas#: 26615-21-4        Compound CID:  5736

Formula:  C₁₈H₁₈ClNOS        Molecular Weight: 331.86

IUPAC Name: 2-(3-chlorobenzo[b][1]benzothiepin-5-yl)oxy-N,N-dimethylethanamine

SMILES: CN(C)CCOC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChIKey: HDOZVRUNCMBHFH-UHFFFAOYSA-N

InChI: InChI=1S/C18H18ClNOS/c1-20(2)9-10-21-16-11-13-5-3-4-6-17(13)22-18-8-7-14(19)12-15(16)18/h3-8,11-12H,9-10H2,1-2H3

Cas#: 50-60-2        Compound CID:  5775

Formula:  C₁₇H₁₉N₃O        Molecular Weight: 281.357

IUPAC Name: 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol

SMILES: CC1=CC=C(C=C1)N(CC2=NCCN2)C3=CC(=CC=C3)O

InChIKey: MRBDMNSDAVCSSF-UHFFFAOYSA-N

InChI: InChI=1S/C17H19N3O/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15/h2-8,11,21H,9-10,12H2,1H3,(H,18,19)

Cas#: 118343-19-4        Compound CID:  121850

Formula:  C₁₃H₁₇N₃C₄H₄O₄        Molecular Weight: 331.37

IUPAC Name: 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1-methyl-1,3-dihydroisoindole

SMILES: CC1N(CC2=NCCN2)CC3=CC=CC=C31.OC(/C=C\C(O)=O)=O

InChIKey: SGOFAUSEYBZKDQ-UHFFFAOYSA-N

InChI: InChI=1S/C13H17N3/c1-10-12-5-3-2-4-11(12)8-16(10)9-13-14-6-7-15-13/h2-5,10H,6-9H2,1H3,(H,14,15)

Cas#: 112192-04-8        Compound CID:  219050

Formula:  C₂₃H₂₆N₂O.HCl        Molecular Weight: 382.93

IUPAC Name: 3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indol-5-ol

SMILES: C1CN(CC=C1C2=CC=CC=C2)CCCCC3=CNC4=C3C=C(C=C4)O

InChIKey: HGEYJZMMUGWEOT-UHFFFAOYSA-N

InChI: InChI=1S/C23H26N2O/c26-21-9-10-23-22(16-21)20(17-24-23)8-4-5-13-25-14-11-19(12-15-25)18-6-2-1-3-7-18/h1-3,6-7,9-11,16-17,24,26H,4-5,8,12-15H2

Cas#: 13523-86-9        Compound CID:  4828

Formula:  C₁₄H₂₀N₂O₂        Molecular Weight: 248.32

IUPAC Name: 1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol

SMILES: CC(C)NCC(COC1=CC=CC2=C1C=CN2)O

InChIKey: JZQKKSLKJUAGIC-UHFFFAOYSA-N

InChI: InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3

Cas#: 868049-49-4        Compound CID:  11504295

Formula:  C₂₁H₂₆N₂O₅        Molecular Weight: 386.44

IUPAC Name: 6-hydroxy-8-[(1R)-1-hydroxy-2-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]ethyl]-4H-1,4-benzoxazin-3-one

SMILES: CC(C)(CC1=CC=C(C=C1)OC)NCC(C2=C3C(=CC(=C2)O)NC(=O)CO3)O

InChIKey: COUYJEVMBVSIHV-SFHVURJKSA-N

InChI: InChI=1S/C21H26N2O5/c1-21(2,10-13-4-6-15(27-3)7-5-13)22-11-18(25)16-8-14(24)9-17-20(16)28-12-19(26)23-17/h4-9,18,22,24-25H,10-12H2,1-3H3,(H,23,26)/t18-/m0/s1

Cas#: 132539-06-1        Compound CID:  135398745

Formula:  C₁₇H₂₀N₄S        Molecular Weight: 312.43

IUPAC Name: 2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepine

SMILES: CC1=CC2=C(S1)NC3=CC=CC=C3N=C2N4CCN(CC4)C

InChIKey: KVWDHTXUZHCGIO-UHFFFAOYSA-N

InChI: InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3

Cas#: 59-42-7        Compound CID:  6041

Formula:  C₉H₁₃NO₂        Molecular Weight: 167.21

IUPAC Name: 3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol

SMILES: CNCC(C1=CC(=CC=C1)O)O

InChIKey: SONNWYBIRXJNDC-VIFPVBQESA-N

InChI: InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1

Cas#: 104054-27-5        Compound CID:  71310

Formula:  C₁₄H₁₆N₂        Molecular Weight: 212.29

IUPAC Name: 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole

SMILES: CCC1(CC2=CC=CC=C2C1)C3=CN=CN3

InChIKey: HSWPZIDYAHLZDD-UHFFFAOYSA-N

InChI: InChI=1S/C14H16N2/c1-2-14(13-9-15-10-16-13)7-11-5-3-4-6-12(11)8-14/h3-6,9-10H,2,7-8H2,1H3,(H,15,16)

Cas#: 51-55-8        Compound CID:  174174

Formula:  C₁₇H₂₃NO₃        Molecular Weight: 289.37

IUPAC Name: [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate

SMILES: CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3

InChIKey: RKUNBYITZUJHSG-PJPHBNEVSA-N

InChI: InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16?