N-[2-(4-fluorophenyl)ethyl]-1-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-1-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-1-methyl-triazole-4-carboxamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-1-methyl-4-triazolecarboxamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-1-methyltriazole-4-carboxamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-1-methyl-triazole-4-carboxamide Formula: C12H13FN4O MolecularWeight: 248.256223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=N1)C(=O)NCCC2=CC=C(C=C2)F

Isomeric SMILES

CN1C=C(N=N1)C(=O)NCCC2=CC=C(C=C2)F

InChI

InChI=1S/C12H13FN4O/c1-17-8-11(15-16-17)12(18)14-7-6-9-2-4-10(13)5-3-9/h2-5,8H,6-7H2,1H3,(H,14,18)