methyl 2-[[4-(3-chloranyl-4-fluoranyl-phenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[4-(3-chloranyl-4-fluoranyl-phenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[4-(3-chloro-4-fluoro-phenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(3-chloro-4-fluorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(3-chloro-4-fluorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(3-chloro-4-fluoro-phenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]acetic acid methyl ester Formula: C17H11Cl3FN3O2S MolecularWeight: 446.710543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NN=C(N1C2=CC(=C(C=C2)F)Cl)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)CSC1=NN=C(N1C2=CC(=C(C=C2)F)Cl)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11Cl3FN3O2S/c1-26-15(25)8-27-17-23-22-16(11-4-2-9(18)6-12(11)19)24(17)10-3-5-14(21)13(20)7-10/h2-7H,8H2,1H3