3-cyano-N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]benzamide

Systemtic Name: 3-cyano-N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]benzamide Openeye Name: 3-cyano-N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]benzamide CAS Name: 3-cyano-N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]benzamide IUPAC Name: 3-cyano-N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]benzamide Traditional Name: 3-cyano-N-[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]benzamide Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H13N5O/c1-11-5-7-13(8-6-11)15-19-17(22-21-15)20-16(23)14-4-2-3-12(9-14)10-18/h2-9H,1H3,(H2,19,20,21,22,23)