Vitas-M small molecule compound
2-{[2,2-dimethyl-5-(2-methylpropyl)-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amino}butan-1-ol
Catalog ID
STL346543
SMILES CCC(Nc1nc(SC)nc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CO
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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 C23H32N4O2S2 MW 460.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O2S2/c1-7-13(10-28)24-20-19-18(26-22(27-20)30-6)17-14-9-23(4,5)29-11-15(14)16(8-12(2)3)25-21(17)31-19/h12-13,28H,7-11H2,1-6H3,(H,24,26,27)InChIKey
KTBQUPDAFIYTJS-UHFFFAOYSA-NSynonyms
848928-92-72((22dimethyl5(2methylpropyl)10(methylsulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)butan1ol
2((5isobutyl22dimethyl10(methylthio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)butan1ol
848928927
CCC(CO)NC1=NC(=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)CC(C)C)SC
InChI=1SC23H32N4O2S2c1713(1028)24201918(2622(2720)306)1714923(45)291115(14)16(812(2)3)2521(17)3119h121328H711H216H3(H242627)
MFCD05678019
ZINC000009016047
ZINC000009016048
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