N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C17H13N5O/c18-10-9-13-1-5-15(6-2-13)21-17(23)14-3-7-16(8-4-14)22-12-19-11-20-22/h1-8,11-12H,9H2,(H,21,23)