3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[(5-fluoro-2-methoxyphenyl)methylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(5-fluoro-2-methoxy-benzyl)thio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]amine Formula: C17H17FN4O2S MolecularWeight: 360.405883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=C(C=CC(=C3)F)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C17H17FN4O2S/c1-23-14-6-3-11(4-7-14)16-20-21-17(22(16)19)25-10-12-9-13(18)5-8-15(12)24-2/h3-9H,10,19H2,1-2H3