Vitas-M small molecule compound

ethyl (2Z)-5-amino-6-cyano-2-(4-hydroxybenzylidene)-7-(4-hydroxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate

Catalog ID
STK871855
SMILES CCOC(=O)C1=c2s/c(=C\c3ccc(cc3)O)/c(=O)n2C(=C(C1c1ccc(cc1)O)C#N)N

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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 C24H19N3O5S MW 461.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O5S/c1-2-32-24(31)20-19(14-5-9-16(29)10-6-14)17(12-25)21(26)27-22(30)18(33-23(20)27)11-13-3-7-15(28)8-4-13/h3-11,19,28-29H,2,26H2,1H3/b18-11-
InChIKey
PRNGWPHJMXIJDB-WQRHYEAKSA-N
Synonyms
5678-53-5
(Z)ethyl5amino6cyano2(4hydroxybenzylidene)7(4hydroxyphenyl)3oxo37dihydro2Hthiazolo(32a)pyridine8carboxylate
5678535
CCOC(=O)C1=C2N(C(=C(C1C3=CC=C(C=C3)O)C#N)N)C(=O)C(=CC4=CC=C(C=C4)O)S2
CCOC(=O)C1=c2sc(=Cc3ccc(cc3)O)c(=O)n2C(=C(C1c1ccc(cc1)O)C#N)N
ethyl(2Z)5amino6cyano2(4hydroxybenzylidene)7(4hydroxyphenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
ETHYL(2Z)5AMINO6CYANO7(4HYDROXYPHENYL)2((4HYDROXYPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
ETHYL5AMINO6CYANO7(4HYDROXYPHENYL)2((4HYDROXYPHENYL)METHYLENE)3OXO47DIHYDRO13THIAZOLIDINO(32A)PYRIDINE8CARBOXYLATE
InChI=1SC24H19N3O5Sc123224(31)2019(145916(29)10614)17(1225)21(26)2722(30)18(3323(20)27)11133715(28)8413h311192829H226H21H3b1811
MFCD01197812
ZINC000002254488
ZINC000002254490

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.