Vitas-M small molecule compound

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

Catalog ID
STK691724
SMILES O=C1CC(c2ccc(cc2)OC(C)C)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 C23H21NO4S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO4S/c1-13(2)28-16-10-8-14(9-11-16)17-12-18(25)24-20-19(15-6-4-3-5-7-15)22(23(26)27)29-21(17)20/h3-11,13,17H,12H2,1-2H3,(H,24,25)(H,26,27)
InChIKey
NYHKZJWVCRZZFE-UHFFFAOYSA-N
Synonyms

5oxo3phenyl7(4(propan2yloxy)phenyl)4567tetrahydrothieno(32b)pyridine2carboxylicacid
5oxo3phenyl7(4propan2yloxyphenyl)67dihydro4Hthieno(32b)pyridine2carboxylicacid
CC(C)OC1=CC=C(C=C1)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O
InChI=1SC23H21NO4Sc113(2)281610814(91116)171218(25)242019(156435715)22(23(26)27)2921(17)20h3111317H12H212H3(H2425)(H2627)
MFCD10037821
ZINC000015081446
ZINC000015081448

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Available files

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