Vitas-M small molecule compound

N-(1,3-benzodioxol-5-yl)-2-[3-(3,5-difluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide

Catalog ID
STL078430
SMILES O=C(Cn1c2ccsc2c(=O)n(c1=O)c1cc(F)cc(c1)F)Nc1ccc2c(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 C21H13F2N3O5S MW 457.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13F2N3O5S/c22-11-5-12(23)7-14(6-11)26-20(28)19-15(3-4-32-19)25(21(26)29)9-18(27)24-13-1-2-16-17(8-13)31-10-30-16/h1-8H,9-10H2,(H,24,27)
InChIKey
WNMQSXRRNRICBS-UHFFFAOYSA-N
Synonyms

C1OC2=C(O1)C=C(C=C2)NC(=O)CN3C4=C(C(=O)N(C3=O)C5=CC(=CC(=C5)F)F)SC=C4
InChI=1SC21H13F2N3O5Sc2211512(23)714(611)2620(28)1915(343219)25(21(26)29)918(27)2413121617(813)31103016h18H910H2(H2427)
MFCD18199639
N(13benzodioxol5yl)2(3(35difluorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
N(13benzodioxol5yl)2(3(35difluorophenyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057494213
ZINC57494213

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Available files

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