2-ethanimidoyl-3-oxidanylidene-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-(1H-1,2,4-triazol-5-ylthio)butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-(1H-1,2,4-triazol-5-ylthio)butyronitrile Formula: C8H9N5OS MolecularWeight: 223.25496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC=NN1

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC=NN1

InChI

InChI=1S/C8H9N5OS/c1-5(10)6(2-9)7(14)3-15-8-11-4-12-13-8/h4,6,10H,3H2,1H3,(H,11,12,13)