2-[2,4-bis(fluoranyl)phenyl]-3-(6-methylsulfanylpyridin-3-yl)-1-(1,2,4-triazol-1-yl)but-3-en-2-ol

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-3-(6-methylsulfanylpyridin-3-yl)-1-(1,2,4-triazol-1-yl)but-3-en-2-ol Openeye Name: 2-(2,4-difluorophenyl)-3-(6-methylsulfanyl-3-pyridyl)-1-(1,2,4-triazol-1-yl)but-3-en-2-ol CAS Name: 2-(2,4-difluorophenyl)-3-[6-(methylthio)-3-pyridinyl]-1-(1,2,4-triazol-1-yl)-3-buten-2-ol IUPAC Name: 2-(2,4-difluorophenyl)-3-(6-methylsulfanylpyridin-3-yl)-1-(1,2,4-triazol-1-yl)but-3-en-2-ol Traditional Name: 2-(2,4-difluorophenyl)-3-[6-(methylthio)-3-pyridyl]-1-(1,2,4-triazol-1-yl)but-3-en-2-ol Formula: C18H16F2N4OS MolecularWeight: 374.407646

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=C1)C(=C)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

Isomeric SMILES

CSC1=NC=C(C=C1)C(=C)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

InChI

InChI=1S/C18H16F2N4OS/c1-12(13-3-6-17(26-2)22-8-13)18(25,9-24-11-21-10-23-24)15-5-4-14(19)7-16(15)20/h3-8,10-11,25H,1,9H2,2H3