2-(4-methylphenyl)-5-oxidanylidene-6-phenyl-pyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile

Systemtic Name: 2-(4-methylphenyl)-5-oxidanylidene-6-phenyl-pyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile Openeye Name: 5-oxo-6-phenyl-2-(p-tolyl)pyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile CAS Name: 2-(4-methylphenyl)-5-oxo-6-phenyl-7-pyrrolo[1,2-b][1,2,4]triazolecarbonitrile IUPAC Name: 2-(4-methylphenyl)-5-oxo-6-phenylpyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile Traditional Name: 5-keto-6-phenyl-2-(p-tolyl)pyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile Formula: C19H12N4O MolecularWeight: 312.32478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C(=N2)C(=C(C3=O)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C(=N2)C(=C(C3=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C19H12N4O/c1-12-7-9-14(10-8-12)17-21-18-15(11-20)16(19(24)23(18)22-17)13-5-3-2-4-6-13/h2-10H,1H3