Vitas-M small molecule compound

3-(4-fluorophenyl)-5-oxo-7-[4-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid

Catalog ID
STK692060
SMILES O=C1CC(c2ccc(cc2)C(F)(F)F)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 C21H13F4NO3S MW 435.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13F4NO3S/c22-13-7-3-11(4-8-13)16-17-18(30-19(16)20(28)29)14(9-15(27)26-17)10-1-5-12(6-2-10)21(23,24)25/h1-8,14H,9H2,(H,26,27)(H,28,29)
InChIKey
SGEXJAMMPHHDDU-UHFFFAOYSA-N
Synonyms

3(4fluorophenyl)5oxo7(4(trifluoromethyl)phenyl)4567tetrahydrothieno(32b)pyridine2carboxylicacid
3(4fluorophenyl)5oxo7(4(trifluoromethyl)phenyl)67dihydro4Hthieno(32b)pyridine2carboxylicacid
C1C(C2=C(C(=C(S2)C(=O)O)C3=CC=C(C=C3)F)NC1=O)C4=CC=C(C=C4)C(F)(F)F
InChI=1SC21H13F4NO3Sc22137311(4813)161718(3019(16)20(28)29)14(915(27)2617)101512(6210)21(2324)25h1814H9H2(H2627)(H2829)
MFCD10038028
ZINC000015082149
ZINC000015082151

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Available files

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