Vitas-M small molecule compound

7-(4-carboxyphenyl)-3-(3-fluorophenyl)-5-hydroxy-6,7-dihydrothieno[3,2-b]pyridine-2-carboxylic acid

Catalog ID
STL161223
SMILES Fc1cccc(c1)c1c2N=C(O)CC(c2sc1C(=O)O)c1ccc(cc1)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/c22-13-3-1-2-12(8-13)16-17-18(29-19(16)21(27)28)14(9-15(24)23-17)10-4-6-11(7-5-10)20(25)26/h1-8,14H,9H2,(H,23,24)(H,25,26)(H,27,28)
InChIKey
UZYAFRWTXIJYTP-UHFFFAOYSA-N
Synonyms
1282099-55-1
1282099551
7(4carboxyphenyl)3(3fluorophenyl)5hydroxy67dihydrothieno(32b)pyridine2carboxylicacid
7(4carboxyphenyl)3(3fluorophenyl)5oxo67dihydro4Hthieno(32b)pyridine2carboxylicacid
C1C(C2=C(C(=C(S2)C(=O)O)C3=CC(=CC=C3)F)NC1=O)C4=CC=C(C=C4)C(=O)O
InChI=1SC21H14FNO5Sc221331212(813)161718(2919(16)21(27)28)14(915(24)2317)104611(7510)20(25)26h1814H9H2(H2324)(H2526)(H2728)
MFCD20759308
ZINC000061717579
ZINC000061717580

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Available files

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