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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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