Vitas-M small molecule compound
methyl {[2,2-dimethyl-5-(morpholin-4-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
STK836115
SMILES COC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
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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 C21H24N4O4S2 MW 460.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4S2/c1-21(2)8-12-13(9-29-21)18(25-4-6-28-7-5-25)24-19-15(12)16-17(31-19)20(23-11-22-16)30-10-14(26)27-3/h11H,4-10H2,1-3H3InChIKey
IFLMADNWPULJJJ-UHFFFAOYSA-NSynonyms
CC1(CC2=C3C4=C(C(=NC=N4)SCC(=O)OC)SC3=NC(=C2CO1)N5CCOCC5)C
InChI=1SC21H24N4O4S2c121(2)81213(92921)18(2546287525)241915(12)1617(3119)20(23112216)301014(26)273h11H410H213H3
methyl((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)acetate
methyl2((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)acetate
MFCD00698540
ZINC000019313078
ZINC19313078
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