N-[(2S)-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-3-(3-chloranyl-4-methyl-phenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]ethanamide Openeye Name: N-[(1S)-1-[(3-chloro-4-methyl-phenyl)sulfanylmethyl]-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]acetamide CAS Name: N-[(2S)-3-[(3-chloro-4-methylphenyl)thio]-1-(4-methyl-1-piperazinyl)-1-oxopropan-2-yl]acetamide IUPAC Name: N-[(2S)-3-(3-chloro-4-methylphenyl)sulfanyl-1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]acetamide Traditional Name: N-[(1S)-1-[[(3-chloro-4-methyl-phenyl)thio]methyl]-2-keto-2-(4-methylpiperazino)ethyl]acetamide Formula: C17H24ClN3O2S MolecularWeight: 369.90936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClN3O2S/c1-12-4-5-14(10-15(12)18)24-11-16(19-13(2)22)17(23)21-8-6-20(3)7-9-21/h4-5,10,16H,6-9,11H2,1-3H3,(H,19,22)/t16-/m1/s1