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

Systemtic Name: 3-[(2-ethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(2-ethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[(2-ethoxyphenyl)methylthio]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2-ethoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(2-ethoxybenzyl)thio]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole Formula: C18H18FN3OS MolecularWeight: 343.418423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=CC=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3OS/c1-3-23-16-7-5-4-6-14(16)12-24-18-21-20-17(22(18)2)13-8-10-15(19)11-9-13/h4-11H,3,12H2,1-2H3