N-(2-cyanoethyl)-4-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-[4-(m-tolyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-[[4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-[4-(3-methylphenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-[4-(m-tolyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

InChI

InChI=1S/C21H24N4O3S/c1-17-4-2-5-19(16-17)24-12-14-25(15-13-24)21(26)18-6-8-20(9-7-18)29(27,28)23-11-3-10-22/h2,4-9,16,23H,3,11-15H2,1H3