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

Systemtic Name: 5-(2-fluorophenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-fluorophenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-fluorophenyl)-3-[3-(4-methoxyphenoxy)propylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-fluorophenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-fluorophenyl)-3-[3-(4-methoxyphenoxy)propylthio]-1H-1,2,4-triazole Formula: C18H18FN3O2S MolecularWeight: 359.417823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCSC2=NNC(=N2)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC=C(C=C1)OCCCSC2=NNC(=N2)C3=CC=CC=C3F

InChI

InChI=1S/C18H18FN3O2S/c1-23-13-7-9-14(10-8-13)24-11-4-12-25-18-20-17(21-22-18)15-5-2-3-6-16(15)19/h2-3,5-10H,4,11-12H2,1H3,(H,20,21,22)