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

Systemtic Name: 3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(3-fluoro-4-methoxyphenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(3-fluoro-4-methoxy-benzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C10H11FN4OS MolecularWeight: 254.283943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NNC(=N2)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NNC(=N2)N)F

InChI

InChI=1S/C10H11FN4OS/c1-16-8-3-2-6(4-7(8)11)5-17-10-13-9(12)14-15-10/h2-4H,5H2,1H3,(H3,12,13,14,15)