Vitas-M small molecule compound
dimethyl 7-(2-hydroxy-5-nitrophenyl)-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate
Catalog ID
STK591802
SMILES COC(=O)C1=C(Sc2c(C1c1cc(ccc1O)[N+](=O)[O-])sc(=O)[nH]2)C(=O)OC
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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 C16H12N2O8S2 MW 424.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O8S2/c1-25-14(20)10-9(7-5-6(18(23)24)3-4-8(7)19)11-13(17-16(22)28-11)27-12(10)15(21)26-2/h3-5,9,19H,1-2H3,(H,17,22)InChIKey
PVTYDKLZQBQGRH-UHFFFAOYSA-NSynonyms
501108-05-0501108050
COC(=O)C1=C(SC2=C(C1C3=C(C=CC(=C3)(N+)(=O)(O))O)SC(=O)N2)C(=O)OC
COC(=O)C1=C(Sc2c(C1c1cc(ccc1O)(N+)(=O)(O))sc(=O)(nH)2)C(=O)OC
dimethyl7(2hydroxy5nitrophenyl)2oxo37dihydro2Hthiopyrano(23d)(13)thiazole56dicarboxylate
dimethyl7(2hydroxy5nitrophenyl)2oxo37dihydro2Hthiopyrano(23d)thiazole56dicarboxylate
DIMETHYL7(2HYDROXY5NITROPHENYL)2OXO37DIHYDROTHIOPYRANO(23D)(13)THIAZOLE56DICARBOXYLATE
InChI=1SC16H12N2O8S2c12514(20)109(756(18(23)24)348(7)19)1113(1716(22)2811)2712(10)15(21)262h35919H12H3(H1722)
METHYL7(2HYDROXY5NITROPHENYL)5(METHOXYCARBONYL)2OXO3H7HTHIINO(23D)13THIAZOLINE6CARBOXYLATE
MFCD03506324
ZINC000013496822
ZINC000013496823
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