2-azanyl-4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile

Systemtic Name: 2-azanyl-4-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile Openeye Name: 2-amino-4-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile CAS Name: 2-amino-4-(1,3-dimethyl-2-oxo-5-benzimidazolyl)buta-1,3-diene-1,1,3-tricarbonitrile IUPAC Name: 2-amino-4-(1,3-dimethyl-2-oxobenzimidazol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile Traditional Name: 2-amino-4-(2-keto-1,3-dimethyl-benzimidazol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile Formula: C16H12N6O MolecularWeight: 304.30608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=C(C#N)C(=C(C#N)C#N)N)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C=C(C#N)C(=C(C#N)C#N)N)N(C1=O)C

InChI

InChI=1S/C16H12N6O/c1-21-13-4-3-10(6-14(13)22(2)16(21)23)5-11(7-17)15(20)12(8-18)9-19/h3-6H,20H2,1-2H3