3-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[[5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[[5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C13H12FN5OS MolecularWeight: 305.330683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1CSC2=NNC(=N2)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(ON=C1CSC2=NNC(=N2)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C13H12FN5OS/c1-7-10(6-21-13-16-12(15)17-18-13)19-20-11(7)8-2-4-9(14)5-3-8/h2-5H,6H2,1H3,(H3,15,16,17,18)