2-[4-[2-(3,4-dimethylphenyl)sulfanylethanoyl]piperazin-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylethanoyl]piperazin-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]-1-piperazinyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[2-[(3,4-dimethylphenyl)thio]acetyl]piperazino]-N-(p-tolyl)acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H29N3O2S/c1-17-4-7-20(8-5-17)24-22(27)15-25-10-12-26(13-11-25)23(28)16-29-21-9-6-18(2)19(3)14-21/h4-9,14H,10-13,15-16H2,1-3H3,(H,24,27)