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Nombre: 4-[(4-metylthiophenyl)methyl]-3-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyloxy)-5-trifluoromethyl-1H-pyrazole

IUPAC: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[[4-[(4-methylsulfanylphenyl)methyl]-5-(trifluoromethyl)-1H-pyrazol-3-yl]oxy]oxan-2-yl]methyl acetate

SMILES: CSc1ccc(Cc2c(O[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)n[nH]c2C(F)(F)F)cc1

Canonical SMILES: CC(=O)OCC1C(C(C(C(O1)OC2=NNC(=C2CC3=CC=C(C=C3)SC)C(F)(F)F)OC(=O)C)OC(=O)C)OC(=O)C

Fórmula molecular: C26H29F3N2O10S

Masa molecular: 618.60

InChIKey: VGLCCKDTXOJZJZ-ILJOYBHNSA-N

InChI: InChI=1S/C26H29F3N2O10S/c1-12(32)36-11-19-20(37-13(2)33)21(38-14(3)34)22(39-15(4)35)25(40-19)41-24-18(23(30-31-24)26(27,28)29)10-16-6-8-17(42-5)9-7-16/h6-9,19-22,25H,10-11H2,1-5H3,(H,30,31)/t19-,20-,21+,22-,25+/m1/s1

PubChem CID: 12071712 →

Sinónimos

4-[(4-methylthiophenyl)methyl]-3-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyloxy)-5-tri-fluoromethyl-1H-pyrazoleSCHEMBL22516404-[(4-methylthiophenyl)methyl]-3-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyloxy)-5-trifluoromethyl-1H-pyrazole4-[(4-metylthiophenyl)methyl]-3-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyloxy)-5-tri-fluoromethyl-1H-pyrazole4-[(4-metylthiophenyl)methyl]-3-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyloxy)-5-trifluoromethyl-1H-pyrazole

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