N-[[1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]methyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: N-[[1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]methyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: 2-oxo-N-[[1-(p-tolylmethyl)pyrrolidin-3-yl]methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[[1-[(4-methylphenyl)methyl]-3-pyrrolidinyl]methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[[1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: 2-keto-N-[[1-(4-methylbenzyl)pyrrolidin-3-yl]methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(C2)CNS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(C2)CNS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C23H29N3O3S/c1-17-5-7-18(8-6-17)15-26-12-11-19(16-26)14-24-30(28,29)21-9-10-22-20(13-21)3-2-4-23(27)25-22/h5-10,13,19,24H,2-4,11-12,14-16H2,1H3,(H,25,27)