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

Systemtic Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-[4-(2,3-dimethylphenyl)piperazino]-2-keto-ethyl]thio]-N-(m-tolyl)acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

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