2-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: 2-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4)NC(=O)C1

InChI

InChI=1S/C24H32N4O3S/c29-24-9-4-8-21-18-22(10-11-23(21)26-24)32(30,31)25-12-5-13-27-14-16-28(17-15-27)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,25H,4-5,8-9,12-17,19H2,(H,26,29)