Vitas-M small molecule compound

ethyl (2Z)-2-(2,6-dichlorobenzylidene)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK089289
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1c(Cl)cccc1Cl)/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 C25H22Cl2N2O5S MW 533.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O5S/c1-5-34-24(31)21-13(2)28-25-29(22(21)14-9-10-18(32-3)19(11-14)33-4)23(30)20(35-25)12-15-16(26)7-6-8-17(15)27/h6-12,22H,5H2,1-4H3/b20-12-
InChIKey
BHPPIDXJAPTANG-NDENLUEZSA-N
Synonyms
324567-71-7
(Z)ethyl2(26dichlorobenzylidene)5(34dimethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
324567717
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1c(Cl)cccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=C(C=CC=C4Cl)Cl)S2)C
ETHYL(2Z)2((26DICHLOROPHENYL)METHYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(26DICHLOROBENZYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H22Cl2N2O5Sc153424(31)2113(2)282529(22(21)1491018(323)19(1114)334)23(30)20(3525)121516(26)76817(15)27h61222H5H214H3b2012
MFCD01794259
STK089289
ZINC000002060486
ZINC000002060488

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Available files

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