N3-(2,4-dimethoxyphenyl)-1-(2-fluorophenyl)-1,2,4-triazole-3,5-diamine

Systemtic Name: N3-(2,4-dimethoxyphenyl)-1-(2-fluorophenyl)-1,2,4-triazole-3,5-diamine Openeye Name: N3-(2,4-dimethoxyphenyl)-1-(2-fluorophenyl)-1,2,4-triazole-3,5-diamine CAS Name: N3-(2,4-dimethoxyphenyl)-1-(2-fluorophenyl)-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-(2,4-dimethoxyphenyl)-1-(2-fluorophenyl)-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-(2-fluorophenyl)-1,2,4-triazol-3-yl]-(2,4-dimethoxyphenyl)amine Formula: C16H16FN5O2 MolecularWeight: 329.328943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NN(C(=N2)N)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NN(C(=N2)N)C3=CC=CC=C3F)OC

InChI

InChI=1S/C16H16FN5O2/c1-23-10-7-8-12(14(9-10)24-2)19-16-20-15(18)22(21-16)13-6-4-3-5-11(13)17/h3-9H,1-2H3,(H3,18,19,20,21)