Vitas-M small molecule compound
8-(2-methylprop-2-en-1-yl)-9-{[2-oxo-2-(2-oxo-1-oxaspiro[4.5]dec-4-yl)ethyl]sulfanyl}-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Catalog ID
STL238666
SMILES CC(=C)Cn1c(SCC(=O)C2CC(=O)OC32CCCCC3)nc2c(c1=O)c1CCc3c(c1s2)cccc3
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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 C29H30N2O4S2 MW 534.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O4S2/c1-17(2)15-31-27(34)24-20-11-10-18-8-4-5-9-19(18)25(20)37-26(24)30-28(31)36-16-22(32)21-14-23(33)35-29(21)12-6-3-7-13-29/h4-5,8-9,21H,1,3,6-7,10-16H2,2H3InChIKey
UJZBNXQCHQAELD-UHFFFAOYSA-NSynonyms
799802-11-2799802112
8(2methylallyl)9((2oxo2(2oxo1oxaspiro(45)decan4yl)ethyl)thio)56dihydronaphtho(2145)thieno(23d)pyrimidin7(8H)one
8(2methylprop2en1yl)9((2oxo2(2oxo1oxaspiro(45)dec4yl)ethyl)sulfanyl)58dihydronaphtho(2145)thieno(23d)pyrimidin7(6H)one
CC(=C)CN1C(=O)C2=C(N=C1SCC(=O)C3CC(=O)OC34CCCCC4)SC5=C2CCC6=CC=CC=C65
InChI=1SC29H30N2O4S2c117(2)153127(34)2420111018845919(18)25(20)3726(24)3028(31)361622(32)211423(33)3529(21)126371329h458921H13671016H22H3
MFCD03678780
ZINC000002224513
ZINC000002224515
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