4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylthio]-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[3-(4-methoxyphenoxy)propylthio]-1,2,4-triazole Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)OCCCSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H22FN3O2S/c1-26-16-9-11-17(12-10-16)27-13-4-14-28-21-24-23-20(25(21)15-7-8-15)18-5-2-3-6-19(18)22/h2-3,5-6,9-12,15H,4,7-8,13-14H2,1H3