2-ethanimidoyl-4-(1-methylimidazol-2-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-(1-methylimidazol-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-(1-methylimidazol-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[(1-methyl-2-imidazolyl)thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-(1-methylimidazol-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(1-methylimidazol-2-yl)thio]butyronitrile Formula: C10H12N4OS MolecularWeight: 236.29348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC=CN1C

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC=CN1C

InChI

InChI=1S/C10H12N4OS/c1-7(12)8(5-11)9(15)6-16-10-13-3-4-14(10)2/h3-4,8,12H,6H2,1-2H3