N-(3,5-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide Openeye Name: N-(3,5-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)-2-oxo-ethoxy]benzenesulfonamide CAS Name: N-(3,5-dimethylphenyl)-4-[2-(4-methyl-1-piperazinyl)-2-oxoethoxy]benzenesulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethoxy]benzenesulfonamide Traditional Name: N-(3,5-dimethylphenyl)-4-[2-keto-2-(4-methylpiperazino)ethoxy]benzenesulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C)C

InChI

InChI=1S/C21H27N3O4S/c1-16-12-17(2)14-18(13-16)22-29(26,27)20-6-4-19(5-7-20)28-15-21(25)24-10-8-23(3)9-11-24/h4-7,12-14,22H,8-11,15H2,1-3H3