N-(3,5-dimethylphenyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3,5-dimethylphenyl)-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-(3,5-dimethylphenyl)-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3,5-dimethylphenyl)-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-(3,5-dimethylphenyl)-4-keto-butyramide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27N3O4S/c1-17-14-18(2)16-19(15-17)23-21(26)8-9-22(27)24-10-12-25(13-11-24)30(28,29)20-6-4-3-5-7-20/h3-7,14-16H,8-13H2,1-2H3,(H,23,26)