Vitas-M small molecule compound
7-(3-bromo-4-fluorophenyl)-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Catalog ID
STK692832
SMILES O=C1CC(c2ccc(c(c2)Br)F)c2c(N1)c(c1ccccc1)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 C20H13BrFNO3S MW 446.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrFNO3S/c21-13-8-11(6-7-14(13)22)12-9-15(24)23-17-16(10-4-2-1-3-5-10)19(20(25)26)27-18(12)17/h1-8,12H,9H2,(H,23,24)(H,25,26)InChIKey
HDVQAVPCQBRRHA-UHFFFAOYSA-NSynonyms
7(3bromo4fluorophenyl)5oxo3phenyl4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(3bromo4fluorophenyl)5oxo3phenyl67dihydro4Hthieno(32b)pyridine2carboxylicacid
C1C(C2=C(C(=C(S2)C(=O)O)C3=CC=CC=C3)NC1=O)C4=CC(=C(C=C4)F)Br
InChI=1SC20H13BrFNO3Sc2113811(6714(13)22)12915(24)231716(104213510)19(20(25)26)2718(12)17h1812H9H2(H2324)(H2526)
MFCD10038849
ZINC000015084948
ZINC000015084949
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