4-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-3-keto-butyronitrile Formula: C12H12N6OS2 MolecularWeight: 320.39328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1N)C2=CC=CS2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(N1N)C2=CC=CS2

InChI

InChI=1S/C12H12N6OS2/c1-7(14)8(5-13)9(19)6-21-12-17-16-11(18(12)15)10-3-2-4-20-10/h2-4,8,14H,6,15H2,1H3