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

Systemtic Name: N-[4-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[3-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[4-methyl-1-oxo-1-(4-phenyl-1-piperazinyl)pentan-2-yl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: 2-keto-N-[3-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C26H34N4O4S MolecularWeight: 498.63756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C26H34N4O4S/c1-19(2)17-24(26(32)30-15-13-29(14-16-30)21-8-4-3-5-9-21)28-35(33,34)22-11-12-23-20(18-22)7-6-10-25(31)27-23/h3-5,8-9,11-12,18-19,24,28H,6-7,10,13-17H2,1-2H3,(H,27,31)