N-(2-cyano-3-methyl-butan-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[(1-methylimidazol-2-yl)thio]propionamide Formula: C13H20N4OS MolecularWeight: 280.3891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)SC1=NC=CN1C

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)C(C)SC1=NC=CN1C

InChI

InChI=1S/C13H20N4OS/c1-9(2)13(4,8-14)16-11(18)10(3)19-12-15-6-7-17(12)5/h6-7,9-10H,1-5H3,(H,16,18)