Vitas-M small molecule compound
ethyl 4-{[(3,5-dinitrophenyl)carbonyl]amino}-3-ethyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK539312
SMILES CCOC(=O)c1sc(=S)n(c1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CC
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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 C15H14N4O7S2 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O7S2/c1-3-17-12(11(28-15(17)27)14(21)26-4-2)16-13(20)8-5-9(18(22)23)7-10(6-8)19(24)25/h5-7H,3-4H2,1-2H3,(H,16,20)InChIKey
ATYJTWKSEWBFBR-UHFFFAOYSA-NSynonyms
371140-53-3371140533
CCN1C(=C(SC1=S)C(=O)OCC)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1sc(=S)n(c1NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))CC
ethyl4(((35dinitrophenyl)carbonyl)amino)3ethyl2thioxo23dihydro13thiazole5carboxylate
ETHYL4((35DINITROBENZOYL)AMINO)3ETHYL2SULFANYLIDENE13THIAZOLE5CARBOXYLATE
ETHYL4((35DINITROBENZOYL)AMINO)3ETHYL2THIOXO23DIHYDRO13THIAZOLE5CARBOXYLATE
ethyl4(35dinitrobenzamido)3ethyl2thioxo23dihydrothiazole5carboxylate
InChI=1SC15H14N4O7S2c131712(11(2815(17)27)14(21)2642)1613(20)859(18(22)23)710(68)19(24)25h57H34H212H3(H1620)
MFCD03009173
ZINC000002315164
ZINC2315164
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