4-(1H-benzimidazol-2-ylsulfanyl)-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-(1H-benzimidazol-2-ylthio)-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-(1H-benzimidazol-2-ylthio)-3-keto-butyronitrile Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C13H12N4OS/c1-8(15)9(6-14)12(18)7-19-13-16-10-4-2-3-5-11(10)17-13/h2-5,9,15H,7H2,1H3,(H,16,17)