4-cyclopropyl-3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2,5-dimethoxyphenyl)methylthio]-5-(2-fluorophenyl)-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2,5-dimethoxybenzyl)thio]-5-(2-fluorophenyl)-1,2,4-triazole Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

InChI

InChI=1S/C20H20FN3O2S/c1-25-15-9-10-18(26-2)13(11-15)12-27-20-23-22-19(24(20)14-7-8-14)16-5-3-4-6-17(16)21/h3-6,9-11,14H,7-8,12H2,1-2H3