Vitas-M small molecule compound
4-chloro-N-[4-hydroxy-1-(4-methoxyphenyl)-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzenesulfonamide
Catalog ID
STK560932
SMILES COc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NS(=O)(=O)c1ccc(cc1)Cl)C(F)(F)F)O
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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 C20H14ClF3N4O6S MW 530.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClF3N4O6S/c1-34-12-6-4-11(5-7-12)28-15-14(16(29)26-18(28)31)19(17(30)25-15,20(22,23)24)27-35(32,33)13-8-2-10(21)3-9-13/h2-9,27H,1H3,(H,25,30)(H,26,29,31)InChIKey
UHJBMHGOKUQDBE-UHFFFAOYSA-NSynonyms
579443-75-74CHLORON(1(4METHOXYPHENYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)BENZENESULFONAMIDE
4chloroN(4hydroxy1(4methoxyphenyl)26dioxo5(trifluoromethyl)2567tetrahydro1Hpyrrolo(23d)pyrimidin5yl)benzenesulfonamide
579443757
COC1=CC=C(C=C1)N2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NS(=O)(=O)C4=CC=C(C=C4)Cl
InChI=1SC20H14ClF3N4O6Sc134126411(5712)281514(16(29)2618(28)31)19(17(30)251520(2223)24)2735(3233)138210(21)3913h2927H1H3(H2530)(H262931)
MFCD04075776
ZINC000100868989
ZINC000100868992
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