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

Systemtic Name: 4-(3-ethanoyl-6-oxidanylidene-5-phenyl-2,5-dihydro-1,2,4-triazin-1-yl)benzenecarbonitrile Openeye Name: 4-(3-acetyl-6-oxo-5-phenyl-2,5-dihydro-1,2,4-triazin-1-yl)benzonitrile CAS Name: 4-(3-acetyl-6-oxo-5-phenyl-2,5-dihydro-1,2,4-triazin-1-yl)benzonitrile IUPAC Name: 4-(3-acetyl-6-oxo-5-phenyl-2,5-dihydro-1,2,4-triazin-1-yl)benzonitrile Traditional Name: 4-(3-acetyl-6-keto-5-phenyl-2,5-dihydro-1,2,4-triazin-1-yl)benzonitrile Formula: C18H14N4O2 MolecularWeight: 318.32936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O2/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/h2-10,16H,1H3,(H,20,21)