N-methyl-2-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-2-phenylazanyl-ethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-methyl-2-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-2-phenylazanyl-ethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(2-anilino-2-oxo-ethyl)-N-methyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(2-anilino-2-oxoethyl)-N-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(2-anilino-2-oxoethyl)-N-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(2-anilino-2-keto-ethyl)-N-methyl-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)N(C)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)N(C)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-19-12-14-23(15-13-19)34(32,33)29-17-21-9-7-6-8-20(21)16-24(29)26(31)28(2)18-25(30)27-22-10-4-3-5-11-22/h3-15,24H,16-18H2,1-2H3,(H,27,30)