Vitas-M small molecule compound
ethyl {[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]sulfanyl}acetate
Catalog ID
STL234085
SMILES CCOC(=O)CSc1ncnc2c1sc1c2c2CC(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 C22H26N4O3S2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3S2/c1-4-28-15(27)11-30-21-18-17(23-12-24-21)16-13-9-22(2,3)29-10-14(13)19(25-20(16)31-18)26-7-5-6-8-26/h12H,4-11H2,1-3H3InChIKey
WZNKFPIWZXWFQX-UHFFFAOYSA-NSynonyms
861139-00-6861139006
CCOC(=O)CSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)N5CCCC5
ethyl((22dimethyl5(pyrrolidin1yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)acetate
ethyl2((22dimethyl5(pyrrolidin1yl)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)acetate
InChI=1SC22H26N4O3S2c142815(27)1130211817(23122421)1613922(23)291014(13)19(2520(16)3118)26756826h12H411H213H3
MFCD03676964
ZINC000020463869
ZINC20463869
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