Vitas-M small molecule compound
2,2-dimethyl-8-(octylsulfanyl)-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STL235876
SMILES CCCCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1
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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 C26H36N4OS2 MW 484.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N4OS2/c1-4-5-6-7-8-11-14-32-25-22-21(27-17-28-25)20-18-15-26(2,3)31-16-19(18)23(29-24(20)33-22)30-12-9-10-13-30/h17H,4-16H2,1-3H3InChIKey
UDFIUBISWBPKLA-UHFFFAOYSA-NSynonyms
848999-10-022dimethyl8(octylsulfanyl)5(pyrrolidin1yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
22dimethyl8(octylthio)5(pyrrolidin1yl)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
848999100
CCCCCCCCSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)N5CCCC5
InChI=1SC26H36N4OS2c145678111432252221(27172825)20181526(23)311619(18)23(2924(20)3322)30129101330h17H416H213H3
MFCD03675593
ZINC000097954867
ZINC97954867
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