2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-[(2,4-dimethylanilino)-oxomethyl]propanamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-[(2,4-dimethylphenyl)carbamoyl]propionamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC(=C(C=C2C#N)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC(=C(C=C2C#N)C(=O)C)C)C

InChI

InChI=1S/C21H22N4O3S/c1-11-6-7-18(12(2)8-11)24-21(28)25-19(27)15(5)29-20-16(10-22)9-17(14(4)26)13(3)23-20/h6-9,15H,1-5H3,(H2,24,25,27,28)