3-[3-(4-fluoranylphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[3-(4-fluoranylphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[3-(4-fluorophenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[3-(4-fluorophenoxy)propylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[3-(4-fluorophenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[3-(4-fluorophenoxy)propylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]amine Formula: C18H19FN4O2S MolecularWeight: 374.432463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2N)SCCCOC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2N)SCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN4O2S/c1-24-15-7-3-13(4-8-15)17-21-22-18(23(17)20)26-12-2-11-25-16-9-5-14(19)6-10-16/h3-10H,2,11-12,20H2,1H3