1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-fluorophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C12H12FN3OS MolecularWeight: 265.306583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN1C=NN=C1SCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H12FN3OS/c1-16-8-14-15-12(16)18-7-6-11(17)9-2-4-10(13)5-3-9/h2-5,8H,6-7H2,1H3