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

Systemtic Name: 4-chloranyl-N-(3,4-dimethylphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-(3,4-dimethylphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-(3,4-dimethylphenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(3,4-dimethylphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-chloro-N-(3,4-dimethylphenyl)-N-[2-(4-formylpiperazino)-2-keto-ethyl]benzenesulfonamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O4S/c1-16-3-6-19(13-17(16)2)25(30(28,29)20-7-4-18(22)5-8-20)14-21(27)24-11-9-23(15-26)10-12-24/h3-8,13,15H,9-12,14H2,1-2H3