4-(3-ethanoyl-6-oxidanylidene-5-phenyl-1,2,4-triazin-1-yl)benzenecarbonitrile

Systemtic Name: 4-(3-ethanoyl-6-oxidanylidene-5-phenyl-1,2,4-triazin-1-yl)benzenecarbonitrile Openeye Name: 4-(3-acetyl-6-oxo-5-phenyl-1,2,4-triazin-1-yl)benzonitrile CAS Name: 4-(3-acetyl-6-oxo-5-phenyl-1,2,4-triazin-1-yl)benzonitrile IUPAC Name: 4-(3-acetyl-6-oxo-5-phenyl-1,2,4-triazin-1-yl)benzonitrile Traditional Name: 4-(3-acetyl-6-keto-5-phenyl-1,2,4-triazin-1-yl)benzonitrile Formula: C18H12N4O2 MolecularWeight: 316.31348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=O)C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)C1=NN(C(=O)C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H12N4O2/c1-12(23)17-20-16(14-5-3-2-4-6-14)18(24)22(21-17)15-9-7-13(11-19)8-10-15/h2-10H,1H3