Vitas-M small molecule compound
ethyl 2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STL304601
SMILES CCOC(=O)C(C(=O)C)Sc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
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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 C24H28N4O5S2 MW 516.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O5S2/c1-5-32-23(30)18(13(2)29)34-22-19-17(25-12-26-22)16-14-10-24(3,4)33-11-15(14)20(27-21(16)35-19)28-6-8-31-9-7-28/h12,18H,5-11H2,1-4H3InChIKey
VTTIAUANOSASCO-UHFFFAOYSA-NSynonyms
844648-43-7844648437
CCOC(=O)C(C(=O)C)SC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)N5CCOCC5
ethyl2((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)3oxobutanoate
ethyl2((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)3oxobutanoate
InChI=1SC24H28N4O5S2c153223(30)18(13(2)29)34221917(25122622)16141024(34)331115(14)20(2721(16)3519)2868319728h1218H511H214H3
MFCD02235457
ZINC000009215585
ZINC000013758693
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