2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(3-piperidinosulfonylphenyl)acetamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@H]1CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O4S/c1-18(28)27-15-12-19-8-3-4-11-22(19)23(27)17-24(29)25-20-9-7-10-21(16-20)32(30,31)26-13-5-2-6-14-26/h3-4,7-12,15-16,23H,2,5-6,13-14,17H2,1H3,(H,25,29)/t23-/m1/s1