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

Systemtic Name: N-(3,4-diethoxyphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(3,4-diethoxyphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide CAS Name: N-(3,4-diethoxyphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(3,4-diethoxyphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(3,4-diethoxyphenyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C20H21FN4O3 MolecularWeight: 384.404143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=NN(C(=N2)C)C3=CC=C(C=C3)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=NN(C(=N2)C)C3=CC=C(C=C3)F)OCC

InChI

InChI=1S/C20H21FN4O3/c1-4-27-17-11-8-15(12-18(17)28-5-2)23-20(26)19-22-13(3)25(24-19)16-9-6-14(21)7-10-16/h6-12H,4-5H2,1-3H3,(H,23,26)