1-[3,4-bis(fluoranyl)phenyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(3,4-difluorophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(3,4-difluorophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(3,4-difluorophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(3,4-difluorophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C14H9F2N3OS2 MolecularWeight: 337.367566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2)SCC(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2)SCC(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C14H9F2N3OS2/c15-9-4-3-8(6-10(9)16)11(20)7-22-14-17-13(18-19-14)12-2-1-5-21-12/h1-6H,7H2,(H,17,18,19)