2-(3-azanylpyridin-4-yl)sulfanyl-N-(2-cyano-3-methyl-butan-2-yl)ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-(2-cyano-3-methyl-butan-2-yl)ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-(1-cyano-1,2-dimethyl-propyl)acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-(2-cyano-3-methylbutan-2-yl)acetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-(2-cyano-3-methylbutan-2-yl)acetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-(1-cyano-1,2-dimethyl-propyl)acetamide Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=C(C=NC=C1)N

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CSC1=C(C=NC=C1)N

InChI

InChI=1S/C13H18N4OS/c1-9(2)13(3,8-14)17-12(18)7-19-11-4-5-16-6-10(11)15/h4-6,9H,7,15H2,1-3H3,(H,17,18)