3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-4-(2-methoxyphenyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-4-(2-methoxyphenyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-4-(2-methoxyphenyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(4-bromo-2-fluorophenyl)methylthio]-4-(2-methoxyphenyl)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylsulfanyl]-4-(2-methoxyphenyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(4-bromo-2-fluoro-benzyl)thio]-4-(2-methoxyphenyl)-5-(2-thienyl)-1,2,4-triazole Formula: C20H15BrFN3OS2 MolecularWeight: 476.385003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCC3=C(C=C(C=C3)Br)F)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCC3=C(C=C(C=C3)Br)F)C4=CC=CS4

InChI

InChI=1S/C20H15BrFN3OS2/c1-26-17-6-3-2-5-16(17)25-19(18-7-4-10-27-18)23-24-20(25)28-12-13-8-9-14(21)11-15(13)22/h2-11H,12H2,1H3