N-[(2-chlorophenyl)methyl]-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[(2-chlorophenyl)methyl]propanamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-[(2-chlorophenyl)methyl]propanamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[(2-chlorophenyl)methyl]propanamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-(2-chlorobenzyl)propionamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C)C(=O)NCC2=CC=CC=C2Cl)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SC(C)C(=O)NCC2=CC=CC=C2Cl)C#N)C(=O)C

InChI

InChI=1S/C19H18ClN3O2S/c1-11-16(12(2)24)8-15(9-21)19(23-11)26-13(3)18(25)22-10-14-6-4-5-7-17(14)20/h4-8,13H,10H2,1-3H3,(H,22,25)