4-[(diphenylmethyl)amino]-N-[3-(4-methylpiperazin-1-yl)propyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(diphenylmethyl)amino]-N-[3-(4-methylpiperazin-1-yl)propyl]-3-nitro-benzenesulfonamide Openeye Name: 4-(benzhydrylamino)-N-[3-(4-methylpiperazin-1-yl)propyl]-3-nitro-benzenesulfonamide CAS Name: 4-[(diphenylmethyl)amino]-N-[3-(4-methyl-1-piperazinyl)propyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-(benzhydrylamino)-N-[3-(4-methylpiperazin-1-yl)propyl]-3-nitrobenzenesulfonamide Traditional Name: 4-(benzhydrylamino)-N-[3-(4-methylpiperazino)propyl]-3-nitro-benzenesulfonamide Formula: C27H33N5O4S MolecularWeight: 523.64702

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNS(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCCNS(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H33N5O4S/c1-30-17-19-31(20-18-30)16-8-15-28-37(35,36)24-13-14-25(26(21-24)32(33)34)29-27(22-9-4-2-5-10-22)23-11-6-3-7-12-23/h2-7,9-14,21,27-29H,8,15-20H2,1H3