N-(4-methylphenyl)-2-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-[1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]sulfanylacetamide Traditional Name: 2-[[2-keto-1-methyl-2-(4-phenylpiperazino)ethyl]thio]-N-(p-tolyl)acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-17-8-10-19(11-9-17)23-21(26)16-28-18(2)22(27)25-14-12-24(13-15-25)20-6-4-3-5-7-20/h3-11,18H,12-16H2,1-2H3,(H,23,26)