Vitas-M small molecule compound
1-(2-ethoxyphenyl)-7-(5-ethylthiophen-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179627
SMILES CCOc1ccccc1n1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1ccc(s1)CC
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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 C22H18F3N3O2S2 MW 477.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O2S2/c1-3-12-9-10-17(32-12)14-11-13(22(23,24)25)18-19(26-14)28(21(31)27-20(18)29)15-7-5-6-8-16(15)30-4-2/h5-11H,3-4H2,1-2H3,(H,27,29,31)InChIKey
AQQHIJZEZIUJCG-UHFFFAOYSA-NSynonyms
1011383-04-21(2ethoxyphenyl)7(5ethylthiophen2yl)2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
1(2ethoxyphenyl)7(5ethylthiophen2yl)2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
1011383042
CCC1=CC=C(S1)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)NC(=S)N3C4=CC=CC=C4OCC
InChI=1SC22H18F3N3O2S2c131291017(3212)141113(22(2324)25)1819(2614)28(21(31)2720(18)29)15756816(15)3042h511H34H212H3(H272931)
MFCD09472718
ZINC000020615667
ZINC20615667
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