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

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]butyronitrile Formula: C11H15N5O2S MolecularWeight: 281.3341

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C(C#N)C(=N)C

InChI

InChI=1S/C11H15N5O2S/c1-3-4-16-10(18)14-15-11(16)19-6-9(17)8(5-12)7(2)13/h8,13H,3-4,6H2,1-2H3,(H,14,18)