2-chloranyl-N-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 5-(4-benzylpiperazine-1-carbonyl)-2-chloro-N-(m-tolyl)benzenesulfonamide CAS Name: 2-chloro-N-(3-methylphenyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 5-(4-benzylpiperazine-1-carbonyl)-2-chloro-N-(3-methylphenyl)benzenesulfonamide Traditional Name: 5-(4-benzylpiperazine-1-carbonyl)-2-chloro-N-(m-tolyl)benzenesulfonamide Formula: C25H26ClN3O3S MolecularWeight: 484.01024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN3O3S/c1-19-6-5-9-22(16-19)27-33(31,32)24-17-21(10-11-23(24)26)25(30)29-14-12-28(13-15-29)18-20-7-3-2-4-8-20/h2-11,16-17,27H,12-15,18H2,1H3