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

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(3,4-difluorophenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(3,4-difluorophenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(3,4-difluorophenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(3,4-difluorophenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C13H13F2N3O2S MolecularWeight: 313.323026

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NN=C1SCC(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

COCCN1C=NN=C1SCC(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H13F2N3O2S/c1-20-5-4-18-8-16-17-13(18)21-7-12(19)9-2-3-10(14)11(15)6-9/h2-3,6,8H,4-5,7H2,1H3