Vitas-M small molecule compound
ethyl 2-{[(3,5-dinitrophenyl)carbonyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Catalog ID
STK019934
SMILES CCOC(=O)c1c(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])sc2c1CC(C)(C)OC2
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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 C19H19N3O8S MW 449.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O8S/c1-4-29-18(24)15-13-8-19(2,3)30-9-14(13)31-17(15)20-16(23)10-5-11(21(25)26)7-12(6-10)22(27)28/h5-7H,4,8-9H2,1-3H3,(H,20,23)InChIKey
JQIFMBDPUZBBGT-UHFFFAOYSA-NSynonyms
371214-95-8371214958
CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2cc(cc(c2)(N+)(=O)(O))(N+)(=O)(O))sc2c1CC(C)(C)OC2
ETHYL2(((35DINITROPHENYL)CARBONYL)AMINO)55DIMETHYL47DIHYDRO5HTHIENO(23C)PYRAN3CARBOXYLATE
ETHYL2((35DINITROBENZOYL)AMINO)55DIMETHYL47DIHYDRO5HTHIENO(23C)PYRAN3CARBOXYLATE
ETHYL2((35DINITROBENZOYL)AMINO)55DIMETHYL47DIHYDROTHIENO(23C)PYRAN3CARBOXYLATE
ethyl2(35dinitrobenzamido)55dimethyl57dihydro4Hthieno(23c)pyran3carboxylate
InChI=1SC19H19N3O8Sc142918(24)1513819(23)30914(13)3117(15)2016(23)10511(21(25)26)712(610)22(27)28h57H489H213H3(H2023)
MFCD01565757
STK019934
ZINC000002266359
ZINC02266359
ZINC2266359
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.