N-isoquinolin-5-yl-2-[methyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-isoquinolin-5-yl-2-[methyl(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[benzenesulfonyl(methyl)amino]-N-(5-isoquinolyl)acetamide CAS Name: 2-[benzenesulfonyl(methyl)amino]-N-(5-isoquinolinyl)acetamide IUPAC Name: 2-[benzenesulfonyl(methyl)amino]-N-isoquinolin-5-ylacetamide Traditional Name: 2-[besyl(methyl)amino]-N-(5-isoquinolyl)acetamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC2=C1C=CN=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC2=C1C=CN=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-21(25(23,24)15-7-3-2-4-8-15)13-18(22)20-17-9-5-6-14-12-19-11-10-16(14)17/h2-12H,13H2,1H3,(H,20,22)