N-(4-methylphenyl)-2-(3-oxidanylidene-3-piperazin-1-yl-propyl)sulfanyl-ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(3-oxidanylidene-3-piperazin-1-yl-propyl)sulfanyl-ethanamide Openeye Name: 2-(3-oxo-3-piperazin-1-yl-propyl)sulfanyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[3-oxo-3-(1-piperazinyl)propyl]thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-(3-oxo-3-piperazin-1-ylpropyl)sulfanylacetamide Traditional Name: 2-[(3-keto-3-piperazino-propyl)thio]-N-(p-tolyl)acetamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCCC(=O)N2CCNCC2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCCC(=O)N2CCNCC2

InChI

InChI=1S/C16H23N3O2S/c1-13-2-4-14(5-3-13)18-15(20)12-22-11-6-16(21)19-9-7-17-8-10-19/h2-5,17H,6-12H2,1H3,(H,18,20)