Vitas-M small molecule compound
7-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(propan-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL181141
SMILES CC(n1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1ccc2c(c1)OCCO2)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 C19H16F3N3O3S MW 423.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N3O3S/c1-9(2)25-16-15(17(26)24-18(25)29)11(19(20,21)22)8-12(23-16)10-3-4-13-14(7-10)28-6-5-27-13/h3-4,7-9H,5-6H2,1-2H3,(H,24,26,29)InChIKey
YQMCGYVCASSJGA-UHFFFAOYSA-NSynonyms
7(23dihydro14benzodioxin6yl)1(propan2yl)2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
7(23dihydro14benzodioxin6yl)1propan2yl2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CC(C)N1C2=C(C(=CC(=N2)C3=CC4=C(C=C3)OCCO4)C(F)(F)F)C(=O)NC1=S
InChI=1SC19H16F3N3O3Sc19(2)251615(17(26)2418(25)29)11(19(2021)22)812(2316)10341314(710)28652713h3479H56H212H3(H242629)
MFCD10701337
ZINC000036617103
ZINC36617103
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