2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-N-[2-(methylthio)phenyl]acetamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC)C

InChI

InChI=1S/C21H27N3O3S2/c1-16-8-9-18(14-17(16)2)29(26,27)24-12-10-23(11-13-24)15-21(25)22-19-6-4-5-7-20(19)28-3/h4-9,14H,10-13,15H2,1-3H3,(H,22,25)