3-[2-(2-fluoranylphenoxy)ethylsulfanyl]-5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(2-fluoranylphenoxy)ethylsulfanyl]-5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazole Openeye Name: 3-[2-(2-fluorophenoxy)ethylsulfanyl]-5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazole CAS Name: 3-[2-(2-fluorophenoxy)ethylthio]-5-(2-methyl-3-furanyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(2-fluorophenoxy)ethylsulfanyl]-5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[2-(2-fluorophenoxy)ethylthio]-5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazole Formula: C21H18FN3O2S MolecularWeight: 395.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=CC=C4F

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCCOC4=CC=CC=C4F

InChI

InChI=1S/C21H18FN3O2S/c1-15-17(11-12-26-15)20-23-24-21(25(20)16-7-3-2-4-8-16)28-14-13-27-19-10-6-5-9-18(19)22/h2-12H,13-14H2,1H3