Vitas-M small molecule compound
7-[4-(propan-2-yl)phenyl]-2-sulfanyl-1-(tetrahydrofuran-2-ylmethyl)-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179151
SMILES CC(c1ccc(cc1)c1cc(c2c(n1)n(CC1CCCO1)c(nc2=O)S)C(F)(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 C22H22F3N3O2S MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3N3O2S/c1-12(2)13-5-7-14(8-6-13)17-10-16(22(23,24)25)18-19(26-17)28(21(31)27-20(18)29)11-15-4-3-9-30-15/h5-8,10,12,15H,3-4,9,11H2,1-2H3,(H,27,29,31)InChIKey
MROCQKONDUBELQ-UHFFFAOYSA-NSynonyms
1011386-27-81(oxolan2ylmethyl)7(4propan2ylphenyl)2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
1011386278
7(4(propan2yl)phenyl)2sulfanyl1(tetrahydrofuran2ylmethyl)5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
CC(C)C1=CC=C(C=C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)NC(=S)N3CC4CCCO4
InChI=1SC22H22F3N3O2Sc112(2)135714(8613)171016(22(2324)25)1819(2617)28(21(31)2720(18)29)11154393015h58101215H34911H212H3(H272931)
MFCD09472877
ZINC000020603278
ZINC000020603281
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