Vitas-M small molecule compound
prop-2-en-1-yl 7-methyl-2,4-dioxo-5-[3-(trifluoromethyl)phenyl]-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STL091080
SMILES C=CCOC(=O)C1=C(C)Nc2c(C1c1cccc(c1)C(F)(F)F)c(=O)[nH]c(=O)[nH]2
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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 C19H16F3N3O4 MW 407.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N3O4/c1-3-7-29-17(27)12-9(2)23-15-14(16(26)25-18(28)24-15)13(12)10-5-4-6-11(8-10)19(20,21)22/h3-6,8,13H,1,7H2,2H3,(H3,23,24,25,26,28)InChIKey
NNMBRHQCUWEXHH-UHFFFAOYSA-NSynonyms
C=CCOC(=O)C1=C(C)Nc2c(C1c1cccc(c1)C(F)(F)F)c(=O)(nH)c(=O)(nH)2
CC1=C(C(C2=C(N1)NC(=O)NC2=O)C3=CC(=CC=C3)C(F)(F)F)C(=O)OCC=C
InChI=1SC19H16F3N3O4c1372917(27)129(2)231514(16(26)2518(28)2415)13(12)1054611(810)19(2021)22h36813H17H22H3(H32324252628)
MFCD18204572
prop2en1yl7methyl24dioxo5(3(trifluoromethyl)phenyl)123458hexahydropyrido(23d)pyrimidine6carboxylate
prop2enyl7methyl24dioxo5(3(trifluoromethyl)phenyl)58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000057531408
ZINC000057531409
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