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

Systemtic Name: 3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[(2,5-dimethoxyphenyl)methylthio]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2,5-dimethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(2,5-dimethoxybenzyl)thio]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Formula: C18H18FN3O2S MolecularWeight: 359.417823

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC(=C2)OC)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC(=C2)OC)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3O2S/c1-22-17(12-4-6-14(19)7-5-12)20-21-18(22)25-11-13-10-15(23-2)8-9-16(13)24-3/h4-10H,11H2,1-3H3