N-[2-(3-chlorophenyl)ethyl]-2-(5-ethanoyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-2-(5-ethanoyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: 2-(5-acetyl-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[2-(3-chlorophenyl)ethyl]acetamide CAS Name: 2-[(5-acetyl-2,6-dimethyl-4-pyrimidinyl)thio]-N-[2-(3-chlorophenyl)ethyl]acetamide IUPAC Name: 2-(5-acetyl-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-[2-(3-chlorophenyl)ethyl]acetamide Traditional Name: 2-[(5-acetyl-2,6-dimethyl-pyrimidin-4-yl)thio]-N-[2-(3-chlorophenyl)ethyl]acetamide Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O2S/c1-11-17(12(2)23)18(22-13(3)21-11)25-10-16(24)20-8-7-14-5-4-6-15(19)9-14/h4-6,9H,7-8,10H2,1-3H3,(H,20,24)