N-[2-(4-chlorophenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCCC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCCC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H18ClN3OS/c1-11-9-12(2)20-16(19-11)22-10-15(21)18-8-7-13-3-5-14(17)6-4-13/h3-6,9H,7-8,10H2,1-2H3,(H,18,21)