Bromodomain-containing proteins

Cas#: 1819363-80-8        Compound CID:  78243717

Formula:  C₁₉H₁₉N₃O₂        Molecular Weight: 321.4

IUPAC Name: (E)-1-(2-hydroxyphenyl)-3-[(1R,4R)-5-pyridin-2-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]prop-2-en-1-one

SMILES: C1C2CN(C1CN2C3=CC=CC=N3)C=CC(=O)C4=CC=CC=C4O

InChIKey: INAICWLVUAKEPB-QSTFCLMHSA-N

InChI: InChI=1S/C19H19N3O2/c23-17-6-2-1-5-16(17)18(24)8-10-21-12-15-11-14(21)13-22(15)19-7-3-4-9-20-19/h1-10,14-15,23H,11-13H2/b10-8+/t14-,15-/m1/s1

IUPAC Name: 1-[(2R)-4-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]-2-methylpiperazin-1-yl]ethanone

SMILES: C[C@@H]1CN(CCN1C(=O)C)c1cc(nnc1N)c1ccccc1O

InChIKey: FHRKRGDHMCCDEO-LLVKDONJSA-N

InChI: InChI=1S/C17H21N5O2/c1-11-10-21(7-8-22(11)12(2)23)15-9-14(19-20-17(15)18)13-5-3-4-6-16(13)24/h3-6,9,11,24H,7-8,10H2,1-2H3,(H2,18,20)/t11-/m1/s1