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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: N-(3-chloro-4-methylphenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(3-chloro-4-methylphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-N-[2-(4-formylpiperazino)-2-keto-ethyl]benzenesulfonamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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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=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O4S/c1-16-7-8-17(13-19(16)21)24(29(27,28)18-5-3-2-4-6-18)14-20(26)23-11-9-22(15-25)10-12-23/h2-8,13,15H,9-12,14H2,1H3