(2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-propyl-propanamide

Systemtic Name: (2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-propyl-propanamide Openeye Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-propyl-propanamide CAS Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-propylpropanamide IUPAC Name: (2S)-2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-propylpropanamide Traditional Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-propyl-propionamide Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC(=C(C=C1C#N)C(=O)C)C

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NC(=C(C=C1C#N)C(=O)C)C

InChI

InChI=1S/C15H19N3O2S/c1-5-6-17-14(20)11(4)21-15-12(8-16)7-13(10(3)19)9(2)18-15/h7,11H,5-6H2,1-4H3,(H,17,20)/t11-/m0/s1