Vitas-M small molecule compound
5-[1-amino-8,8-dimethyl-5-(morpholin-4-ium-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridin-2-yl]furan-2-carboxylate
Catalog ID
STK564672
SMILES [O-]C(=O)c1ccc(o1)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)[NH+]1CCOCC1
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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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-21(2)9-11-12(10-28-21)18(24-5-7-27-8-6-24)23-19-15(11)16(22)17(30-19)13-3-4-14(29-13)20(25)26/h3-4H,5-10,22H2,1-2H3,(H,25,26)InChIKey
IOQUPPKVXXLXOM-UHFFFAOYSA-NSynonyms
378763-92-9(O)C(=O)c1ccc(o1)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)(NH+)1CCOCC1
378763929
5(1AMINO88DIMETHYL5(4MORPHOLINYL)89DIHYDRO6HPYRANO(43D)THIENO(23B)PYRIDIN2YL)2FUROICACID
5(1amino88dimethyl5(morpholin4ium4yl)89dihydro6Hpyrano(43d)thieno(23b)pyridin2yl)furan2carboxylate
CC1(CC2=C3C(=C(SC3=NC(=C2CO1)(NH+)4CCOCC4)C5=CC=C(O5)C(=O)(O))N)C
InChI=1SC21H23N3O5Sc121(2)91112(102821)18(2457278624)231915(11)16(22)17(3019)133414(2913)20(25)26h34H51022H212H3(H2526)
MFCD01565555
ZINC000003635090
ZINC03635090
ZINC3635090
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