N-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]acetamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O2S/c1-16-18(22)8-5-9-19(16)23-20(26)14-28-15-21(27)25-12-10-24(11-13-25)17-6-3-2-4-7-17/h2-9H,10-15H2,1H3,(H,23,26)