2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)ethanone IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone Traditional Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)ethanone Formula: C12H12FN3OS MolecularWeight: 265.306583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H12FN3OS/c1-8-14-15-12(16(8)2)18-7-11(17)9-3-5-10(13)6-4-9/h3-6H,7H2,1-2H3