4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-fluorophenyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C20H22FN3O3S MolecularWeight: 403.470383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C2=NNC(=S)N2C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C2=NNC(=S)N2C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O3S/c1-4-25-16-11-13(12-17(26-5-2)18(16)27-6-3)19-22-23-20(28)24(19)15-9-7-14(21)8-10-15/h7-12H,4-6H2,1-3H3,(H,23,28)