Vitas-M small molecule compound
{4-[(E)-{2,4,6-trioxo-1-[3-(trifluoromethyl)phenyl]tetrahydropyrimidin-5(2H)-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STK533429
SMILES OC(=O)COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1cccc(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 C20H13F3N2O6 MW 434.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13F3N2O6/c21-20(22,23)12-2-1-3-13(9-12)25-18(29)15(17(28)24-19(25)30)8-11-4-6-14(7-5-11)31-10-16(26)27/h1-9H,10H2,(H,26,27)(H,24,28,30)/b15-8+InChIKey
ZUOUVUCTQPERDE-OVCLIPMQSA-NSynonyms
372979-78-7(4((E)(246trioxo1(3(trifluoromethyl)phenyl)tetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
(E)2(4((246trioxo1(3(trifluoromethyl)phenyl)tetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(4((E)(246TRIOXO1(3(TRIFLUOROMETHYL)PHENYL)13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
372979787
C1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)O)C(=O)NC2=O)C(F)(F)F
InChI=1SC20H13F3N2O6c2120(2223)1221313(912)2518(29)15(17(28)2419(25)30)8114614(7511)311016(26)27h19H10H2(H2627)(H242830)b158+
MFCD01954474
OC(=O)COc1ccc(cc1)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F
ZINC000002287138
ZINC2287138
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