3-[(3-bromophenyl)methylsulfanyl]-5-[(4-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-[(4-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3-bromophenyl)methylsulfanyl]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3-bromobenzyl)thio]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazole Formula: C19H17BrFN3OS MolecularWeight: 434.325183

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)COC3=CC=C(C=C3)F

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)COC3=CC=C(C=C3)F

InChI

InChI=1S/C19H17BrFN3OS/c1-2-10-24-18(12-25-17-8-6-16(21)7-9-17)22-23-19(24)26-13-14-4-3-5-15(20)11-14/h2-9,11H,1,10,12-13H2