N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(dimethylamino)-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(dimethylamino)-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(dimethylamino)-5-piperidin-1-ylsulfonylphenyl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(dimethylamino)-5-piperidinosulfonyl-phenyl]acetamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N4O4S/c1-19(31)30-16-13-20-9-5-6-10-22(20)25(30)18-26(32)27-23-17-21(11-12-24(23)28(2)3)35(33,34)29-14-7-4-8-15-29/h5-6,9-13,16-17,25H,4,7-8,14-15,18H2,1-3H3,(H,27,32)