N-(2-ethylphenyl)-2-[4-[2-(4-methylphenyl)sulfanylethanoyl]piperazin-1-yl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)CSC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)CSC3=CC=C(C=C3)C

InChI

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