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

Systemtic Name: N-(4-methylphenyl)-2-[2-oxidanylidene-2-[4-(2-phenylsulfanylethyl)piperazin-1-yl]ethyl]sulfanyl-ethanamide Openeye Name: 2-[2-oxo-2-[4-(2-phenylsulfanylethyl)piperazin-1-yl]ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[2-oxo-2-[4-[2-(phenylthio)ethyl]-1-piperazinyl]ethyl]thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-[2-oxo-2-[4-(2-phenylsulfanylethyl)piperazin-1-yl]ethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-[4-[2-(phenylthio)ethyl]piperazino]ethyl]thio]-N-(p-tolyl)acetamide Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N2CCN(CC2)CCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N2CCN(CC2)CCSC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2S2/c1-19-7-9-20(10-8-19)24-22(27)17-29-18-23(28)26-13-11-25(12-14-26)15-16-30-21-5-3-2-4-6-21/h2-10H,11-18H2,1H3,(H,24,27)