Vitas-M small molecule compound
7-(5-bromo-2-methoxyphenyl)-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Catalog ID
STK692057
SMILES COc1ccc(cc1C1CC(=O)Nc2c1sc(c2c1ccccc1)C(=O)O)Br
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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 C21H16BrNO4S MW 458.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO4S/c1-27-15-8-7-12(22)9-13(15)14-10-16(24)23-18-17(11-5-3-2-4-6-11)20(21(25)26)28-19(14)18/h2-9,14H,10H2,1H3,(H,23,24)(H,25,26)InChIKey
XIZHJSNDKYKGCX-UHFFFAOYSA-NSynonyms
7(5bromo2methoxyphenyl)5oxo3phenyl4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(5bromo2methoxyphenyl)5oxo3phenyl67dihydro4Hthieno(32b)pyridine2carboxylicacid
COC1=C(C=C(C=C1)Br)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O
InChI=1SC21H16BrNO4Sc127158712(22)913(15)141016(24)231817(115324611)20(21(25)26)2819(14)18h2914H10H21H3(H2324)(H2526)
MFCD10038025
ZINC000015082142
ZINC000015082143
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