1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-(3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-(3-thiophenyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-fluorophenyl)-2-[[4-(4-methoxyphenyl)-5-(3-thienyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C21H16FN3O2S2 MolecularWeight: 425.499043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)C4=CSC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)C4=CSC=C4

InChI

InChI=1S/C21H16FN3O2S2/c1-27-18-8-6-17(7-9-18)25-20(15-10-11-28-12-15)23-24-21(25)29-13-19(26)14-2-4-16(22)5-3-14/h2-12H,13H2,1H3