N-aminocarbonyl-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-3-methyl-butanamide

Systemtic Name: N-aminocarbonyl-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-3-methyl-butanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-carbamoyl-3-methyl-butanamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-carbamoyl-3-methylbutanamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-carbamoyl-3-methylbutanamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-carbamoyl-3-methyl-butyramide Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C(C)C)C(=O)NC(=O)N)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SC(C(C)C)C(=O)NC(=O)N)C#N)C(=O)C

InChI

InChI=1S/C15H18N4O3S/c1-7(2)12(13(21)19-15(17)22)23-14-10(6-16)5-11(9(4)20)8(3)18-14/h5,7,12H,1-4H3,(H3,17,19,21,22)