5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethyloxymethyl)-1,2,4-triazole-3-carboxamide

Systemtic Name: 5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethyloxymethyl)-1,2,4-triazole-3-carboxamide Openeye Name: 5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide CAS Name: 5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide Traditional Name: 5-[2-(4-fluorophenyl)ethynyl]-1-(2-hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide Formula: C14H13FN4O3 MolecularWeight: 304.276423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=NC(=NN2COCCO)C(=O)N)F

Isomeric SMILES

C1=CC(=CC=C1C#CC2=NC(=NN2COCCO)C(=O)N)F

InChI

InChI=1S/C14H13FN4O3/c15-11-4-1-10(2-5-11)3-6-12-17-14(13(16)21)18-19(12)9-22-8-7-20/h1-2,4-5,20H,7-9H2,(H2,16,21)