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

Systemtic Name: 3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-[(3-fluoro-4-methoxyphenyl)methylthio]-5-methyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-fluoro-4-methoxy-benzyl)thio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C11H13FN4OS MolecularWeight: 268.310523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=NN=C(N1N)SCC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C11H13FN4OS/c1-7-14-15-11(16(7)13)18-6-8-3-4-10(17-2)9(12)5-8/h3-5H,6,13H2,1-2H3