2-cyano-N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 2-cyano-N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 2-cyano-N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: 2-cyano-N-[2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: 2-cyano-N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: 2-cyano-N-[2-[4-(2,3-dimethylphenyl)piperazino]-2-keto-ethyl]benzenesulfonamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CNS(=O)(=O)C3=CC=CC=C3C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CNS(=O)(=O)C3=CC=CC=C3C#N)C

InChI

InChI=1S/C21H24N4O3S/c1-16-6-5-8-19(17(16)2)24-10-12-25(13-11-24)21(26)15-23-29(27,28)20-9-4-3-7-18(20)14-22/h3-9,23H,10-13,15H2,1-2H3