(2Z)-3-oxidanylidene-2-[(1,2,4-triazol-4-ylamino)methylidene]butanenitrile

Systemtic Name: (2Z)-3-oxidanylidene-2-[(1,2,4-triazol-4-ylamino)methylidene]butanenitrile Openeye Name: (2Z)-3-oxo-2-[(1,2,4-triazol-4-ylamino)methylene]butanenitrile CAS Name: (2Z)-3-oxo-2-[(1,2,4-triazol-4-ylamino)methylidene]butanenitrile IUPAC Name: (2Z)-3-oxo-2-[(1,2,4-triazol-4-ylamino)methylidene]butanenitrile Traditional Name: (Z)-2-acetyl-3-(1,2,4-triazol-4-ylamino)acrylonitrile Formula: C7H7N5O MolecularWeight: 177.16338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNN1C=NN=C1)C#N

Isomeric SMILES

CC(=O)/C(=C\NN1C=NN=C1)/C#N

InChI

InChI=1S/C7H7N5O/c1-6(13)7(2-8)3-11-12-4-9-10-5-12/h3-5,11H,1H3/b7-3-