1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Formula: C13H10N6O MolecularWeight: 266.2581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN3C=NC(=N3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN3C=NC(=N3)C#N

InChI

InChI=1S/C13H10N6O/c1-9-2-4-10(5-3-9)13-16-12(20-18-13)7-19-8-15-11(6-14)17-19/h2-5,8H,7H2,1H3