4-chloranyl-N-[(3-methylphenyl)methyl]-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(3-methylphenyl)methyl]-N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-(m-tolylmethyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[(3-methylphenyl)methyl]-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(3-methylphenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-keto-2-(4-phenylpiperazino)ethyl]-N-(3-methylbenzyl)benzenesulfonamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CN(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H28ClN3O3S/c1-21-6-5-7-22(18-21)19-30(34(32,33)25-12-10-23(27)11-13-25)20-26(31)29-16-14-28(15-17-29)24-8-3-2-4-9-24/h2-13,18H,14-17,19-20H2,1H3