Vitas-M small molecule compound
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[3-(3,5-difluorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL076718
SMILES O=C(CSc1nc2ccsc2c(=O)n1c1cc(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 C22H21F2N3O2S2 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F2N3O2S2/c23-15-10-16(24)12-17(11-15)27-21(29)20-18(7-9-30-20)26-22(27)31-13-19(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
XKDIFJJSDQGUBZ-UHFFFAOYSA-NSynonyms
C1CCC(=CC1)CCNC(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC(=C4)F)F)SC=C3
InChI=1SC22H21F2N3O2S2c23151016(24)1217(1115)2721(29)2018(793020)2622(27)311319(28)2586144213514h47912H1356813H2(H2528)
MFCD18197950
N(2(cyclohex1en1yl)ethyl)2((3(35difluorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(2(cyclohexen1yl)ethyl)2(3(35difluorophenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000057489232
ZINC57489232
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