Vitas-M small molecule compound

dimethyl 7-(3-nitrophenyl)-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate

Catalog ID
STK928017
SMILES COC(=O)C1=C(Sc2c(C1c1cccc(c1)[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 C16H12N2O7S2 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O7S2/c1-24-14(19)10-9(7-4-3-5-8(6-7)18(22)23)11-13(17-16(21)27-11)26-12(10)15(20)25-2/h3-6,9H,1-2H3,(H,17,21)
InChIKey
MSUIXAOPKQHUDR-UHFFFAOYSA-N
Synonyms
501108-07-2
501108072
COC(=O)C1=C(SC2=C(C1C3=CC(=CC=C3)(N+)(=O)(O))SC(=O)N2)C(=O)OC
COC(=O)C1=C(Sc2c(C1c1cccc(c1)(N+)(=O)(O))sc(=O)(nH)2)C(=O)OC
dimethyl7(3nitrophenyl)2oxo37dihydro2Hthiopyrano(23d)(13)thiazole56dicarboxylate
dimethyl7(3nitrophenyl)2oxo37dihydro2Hthiopyrano(23d)thiazole56dicarboxylate
DIMETHYL7(3NITROPHENYL)2OXO37DIHYDROTHIOPYRANO(23D)(13)THIAZOLE56DICARBOXYLATE
InChI=1SC16H12N2O7S2c12414(19)109(74358(67)18(22)23)1113(1716(21)2711)2612(10)15(20)252h369H12H3(H1721)
METHYL5(METHOXYCARBONYL)7(3NITROPHENYL)2OXO3H7HTHIINO(23D)13THIAZOLINE6CARBOXYLATE
MFCD03506326
ZINC000009428424
ZINC000009428425

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Available files

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