1-(2-methylphenyl)-N-prop-2-ynyl-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(2-methylphenyl)-N-prop-2-ynyl-1,2,4-triazole-3-carboxamide Openeye Name: 1-(o-tolyl)-N-prop-2-ynyl-1,2,4-triazole-3-carboxamide CAS Name: 1-(2-methylphenyl)-N-prop-2-ynyl-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(2-methylphenyl)-N-prop-2-ynyl-1,2,4-triazole-3-carboxamide Traditional Name: 1-(o-tolyl)-N-propargyl-1,2,4-triazole-3-carboxamide Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NC(=N2)C(=O)NCC#C

Isomeric SMILES

CC1=CC=CC=C1N2C=NC(=N2)C(=O)NCC#C

InChI

InChI=1S/C13H12N4O/c1-3-8-14-13(18)12-15-9-17(16-12)11-7-5-4-6-10(11)2/h1,4-7,9H,8H2,2H3,(H,14,18)