Vitas-M small molecule compound
1-(butan-2-yl)-7-[3-(difluoromethoxy)phenyl]-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179812
SMILES CCC(n1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1cccc(c1)OC(F)F)C
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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 C19H16F5N3O2S MW 445.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F5N3O2S/c1-3-9(2)27-15-14(16(28)26-18(27)30)12(19(22,23)24)8-13(25-15)10-5-4-6-11(7-10)29-17(20)21/h4-9,17H,3H2,1-2H3,(H,26,28,30)InChIKey
CBFUFUNAJNWOFI-UHFFFAOYSA-NSynonyms
1011383-12-21(butan2yl)7(3(difluoromethoxy)phenyl)2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
1011383122
1butan2yl7(3(difluoromethoxy)phenyl)2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CCC(C)N1C2=C(C(=CC(=N2)C3=CC(=CC=C3)OC(F)F)C(F)(F)F)C(=O)NC1=S
InChI=1SC19H16F5N3O2Sc139(2)271514(16(28)2618(27)30)12(19(2223)24)813(2515)1054611(710)2917(20)21h4917H3H212H3(H262830)
MFCD09472664
ZINC000036617082
ZINC000036617083
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