Vitas-M small molecule compound
2-{[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-phenylethanone
Catalog ID
STL304607
SMILES CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)c1ccccc1)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 C26H27N3O2S2 MW 477.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2S2/c1-15(2)10-19-18-12-31-26(3,4)11-17(18)21-22-23(33-24(21)29-19)25(28-14-27-22)32-13-20(30)16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3InChIKey
KQXNUUAECDAJRD-UHFFFAOYSA-NSynonyms
844862-54-02((22dimethyl5(2methylpropyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1phenylethanone
2((5isobutyl22dimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1phenylethanone
844862540
CC(C)CC1=C2COC(CC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=CC=C5)SC3=N1)(C)C
InChI=1SC26H27N3O2S2c115(2)101918123126(34)1117(18)212223(3324(21)2919)25(28142722)321320(30)168657916h591415H1013H214H3
MFCD02236760
ZINC000002412246
ZINC02412246
ZINC2412246
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