N-[(2R)-3-(4-methylphenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]ethanamide

Systemtic Name: N-[(2R)-3-(4-methylphenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]ethanamide Openeye Name: N-[(1R)-2-(4-methylpiperazin-1-yl)-2-oxo-1-(p-tolylsulfanylmethyl)ethyl]acetamide CAS Name: N-[(2R)-3-[(4-methylphenyl)thio]-1-(4-methyl-1-piperazinyl)-1-oxopropan-2-yl]acetamide IUPAC Name: N-[(2R)-3-(4-methylphenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]acetamide Traditional Name: N-[(1R)-2-keto-2-(4-methylpiperazino)-1-[(p-tolylthio)methyl]ethyl]acetamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C(=O)N2CCN(CC2)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC[C@@H](C(=O)N2CCN(CC2)C)NC(=O)C

InChI

InChI=1S/C17H25N3O2S/c1-13-4-6-15(7-5-13)23-12-16(18-14(2)21)17(22)20-10-8-19(3)9-11-20/h4-7,16H,8-12H2,1-3H3,(H,18,21)/t16-/m0/s1