Vitas-M small molecule compound
2-{[2,2-dimethyl-5-(pyrrolidin-1-yl)-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
STL347589
SMILES CCC(Nc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1)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 C22H29N5O2S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2S/c1-4-13(10-28)25-19-18-17(23-12-24-19)16-14-9-22(2,3)29-11-15(14)20(26-21(16)30-18)27-7-5-6-8-27/h12-13,28H,4-11H2,1-3H3,(H,23,24,25)InChIKey
CBMUGDFCONDZCK-UHFFFAOYSA-NSynonyms
861119-77-92((22dimethyl5(pyrrolidin1yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)butan1ol
2((22dimethyl5(pyrrolidin1yl)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)butan1ol
861119779
CCC(CO)NC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)N5CCCC5
InChI=1SC22H29N5O2Sc1413(1028)25191817(23122419)1614922(23)291115(14)20(2621(16)3018)27756827h121328H411H213H3(H232425)
MFCD05683242
ZINC000020463711
ZINC000020463714
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