Vitas-M small molecule compound
ethyl {[3-cyclohexyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK547418
SMILES CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)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 C22H30N2O4S2 MW 450.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O4S2/c1-4-27-18(25)12-29-22-23-20-19(21(26)24(22)14-8-6-5-7-9-14)15-10-16(13(2)3)28-11-17(15)30-20/h13-14,16H,4-12H2,1-3H3InChIKey
KXINXMWXTAXQSH-UHFFFAOYSA-NSynonyms
500269-15-8500269158
CCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)C(C)C)C(=O)N1C4CCCCC4
ethyl((3cyclohexyl4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((3cyclohexyl4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
ethyl2((3cyclohexyl6isopropyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
InChI=1SC22H30N2O4S2c142718(25)122922232019(21(26)24(22)148657914)151016(13(2)3)281117(15)3020h131416H412H213H3
MFCD03299724
ZINC000002322017
ZINC000002322018
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