Vitas-M small molecule compound

ethyl (2Z)-5-(2-chlorophenyl)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK532861
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C/c1cccc(c1OC)OC)/s2

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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 C25H23ClN2O5S MW 498.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2O5S/c1-5-33-24(30)20-14(2)27-25-28(21(20)16-10-6-7-11-17(16)26)23(29)19(34-25)13-15-9-8-12-18(31-3)22(15)32-4/h6-13,21H,5H2,1-4H3/b19-13-
InChIKey
GNSACJDFUHTBNJ-UYRXBGFRSA-N
Synonyms
372493-82-8
(Z)ethyl5(2chlorophenyl)2(23dimethoxybenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
372493828
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1cccc(c1OC)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=C(C(=CC=C4)OC)OC)S2)C
ETHYL(2Z)5(2CHLOROPHENYL)2((23DIMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(2chlorophenyl)2(23dimethoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23ClN2O5Sc153324(30)2014(2)272528(21(20)1610671117(16)26)23(29)19(3425)1315981218(313)22(15)324h61321H5H214H3b1913
MFCD01942590
ZINC000002276302
ZINC000002276304

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Available files

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