N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide CAS Name: N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(2-tert-butylphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C20H21FN4O MolecularWeight: 352.405343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3C(C)(C)C

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3C(C)(C)C

InChI

InChI=1S/C20H21FN4O/c1-13-22-18(24-25(13)15-11-9-14(21)10-12-15)19(26)23-17-8-6-5-7-16(17)20(2,3)4/h5-12H,1-4H3,(H,23,26)