Vitas-M small molecule compound
{[4-hydroxy-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}(phenyl)acetic acid
Catalog ID
STL406985
SMILES Oc1nc(SC(c2ccccc2)C(=O)O)nc(c1)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H9F3N2O3S MW 330.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9F3N2O3S/c14-13(15,16)8-6-9(19)18-12(17-8)22-10(11(20)21)7-4-2-1-3-5-7/h1-6,10H,(H,20,21)(H,17,18,19)InChIKey
AMYGLRWXUQANHO-UHFFFAOYSA-NSynonyms
1795443-54-7((4hydroxy6(trifluoromethyl)pyrimidin2yl)sulfanyl)(phenyl)aceticacid
1795443547
2((4oxo6(trifluoromethyl)1Hpyrimidin2yl)sulfanyl)2phenylaceticacid
C1=CC=C(C=C1)C(C(=O)O)SC2=NC(=O)C=C(N2)C(F)(F)F
InChI=1SC13H9F3N2O3Sc1413(1516)869(19)1812(178)2210(11(20)21)7421357h1610H(H2021)(H171819)
MFCD30704614
ZINC000096306365
ZINC000096306366
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