Vitas-M small molecule compound
7-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Catalog ID
STK691736
SMILES O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)c(c1ccc(cc1)F)c(s2)C(=O)O
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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 C21H14FNO5S MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14FNO5S/c22-12-4-1-10(2-5-12)17-18-19(29-20(17)21(25)26)13(8-16(24)23-18)11-3-6-14-15(7-11)28-9-27-14/h1-7,13H,8-9H2,(H,23,24)(H,25,26)InChIKey
WUZSUVGWWOXESM-UHFFFAOYSA-NSynonyms
7(13benzodioxol5yl)3(4fluorophenyl)5oxo4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(13benzodioxol5yl)3(4fluorophenyl)5oxo67dihydro4Hthieno(32b)pyridine2carboxylicacid
C1C(C2=C(C(=C(S2)C(=O)O)C3=CC=C(C=C3)F)NC1=O)C4=CC5=C(C=C4)OCO5
InChI=1SC21H14FNO5Sc22124110(2512)171819(2920(17)21(25)26)13(816(24)2318)11361415(711)2892714h1713H89H2(H2324)(H2526)
MFCD10037833
ZINC000015081501
ZINC000015081503
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