Vitas-M small molecule compound

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

Catalog ID
STL078414
SMILES O=C(Cn1c2ccsc2c(=O)n(c1=O)c1cc(F)cc(c1)F)NCCC1=CCCCC1

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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 C22H21F2N3O3S MW 445.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F2N3O3S/c23-15-10-16(24)12-17(11-15)27-21(29)20-18(7-9-31-20)26(22(27)30)13-19(28)25-8-6-14-4-2-1-3-5-14/h4,7,9-12H,1-3,5-6,8,13H2,(H,25,28)
InChIKey
DPVJIHQQPOSPHU-UHFFFAOYSA-N
Synonyms

C1CCC(=CC1)CCNC(=O)CN2C3=C(C(=O)N(C2=O)C4=CC(=CC(=C4)F)F)SC=C3
InChI=1SC22H21F2N3O3Sc23151016(24)1217(1115)2721(29)2018(793120)26(22(27)30)1319(28)2586144213514h47912H1356813H2(H2528)
MFCD18199623
N(2(cyclohex1en1yl)ethyl)2(3(35difluorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
N(2(cyclohexen1yl)ethyl)2(3(35difluorophenyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057494169
ZINC57494169

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Available files

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