3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[(4-bromo-2-fluorophenyl)methylthio]-5-(2-methyl-3-furanyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-bromo-2-fluoro-benzyl)thio]-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C17H15BrFN3OS MolecularWeight: 408.287903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2CC=C)SCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2CC=C)SCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H15BrFN3OS/c1-3-7-22-16(14-6-8-23-11(14)2)20-21-17(22)24-10-12-4-5-13(18)9-15(12)19/h3-6,8-9H,1,7,10H2,2H3