Vitas-M small molecule compound
7-(1,3-benzodioxol-5-yl)-5-(difluoromethyl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179433
SMILES COCCn1c(S)nc(=O)c2c1nc(cc2C(F)F)c1ccc2c(c1)OCO2
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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 C18H15F2N3O4S MW 407.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F2N3O4S/c1-25-5-4-23-16-14(17(24)22-18(23)28)10(15(19)20)7-11(21-16)9-2-3-12-13(6-9)27-8-26-12/h2-3,6-7,15H,4-5,8H2,1H3,(H,22,24,28)InChIKey
XMIHGBHETBSSDZ-UHFFFAOYSA-NSynonyms
1011387-77-11011387771
7(13benzodioxol5yl)5(difluoromethyl)1(2methoxyethyl)2sulfanylidenepyrido(23d)pyrimidin4one
7(13benzodioxol5yl)5(difluoromethyl)1(2methoxyethyl)2sulfanylpyrido(23d)pyrimidin4(1H)one
COCCN1C2=C(C(=CC(=N2)C3=CC4=C(C=C3)OCO4)C(F)F)C(=O)NC1=S
InChI=1SC18H15F2N3O4Sc12554231614(17(24)2218(23)28)10(15(19)20)711(2116)9231213(69)2782612h236715H458H21H3(H222428)
MFCD09473021
ZINC000020604431
ZINC20604431
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