Vitas-M small molecule compound

ethyl (2E)-5-(3,4-dimethoxyphenyl)-2-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK011367
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(c(c1)OC)OCCOc1ccc(cc1)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 C35H36N2O9S MW 660.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N2O9S/c1-7-44-34(39)31-21(2)36-35-37(32(31)23-9-15-26(41-4)29(20-23)43-6)33(38)30(47-35)19-22-8-14-27(28(18-22)42-5)46-17-16-45-25-12-10-24(40-3)11-13-25/h8-15,18-20,32H,7,16-17H2,1-6H3/b30-19+
InChIKey
ZQISHWFAEMCHCK-NDZAJKAJSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(c(c1)OC)OCCOc1ccc(cc1)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=CC(=C(C=C4)OCCOC5=CC=C(C=C5)OC)OC)S2)C
ethyl(2E)5(34dimethoxyphenyl)2((3methoxy4(2(4methoxyphenoxy)ethoxy)phenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)5(34DIMETHOXYPHENYL)2(3METHOXY4(2(4METHOXYPHENOXY)ETHOXY)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC35H36N2O9Sc174434(39)3121(2)363537(32(31)2391526(414)29(2023)436)33(38)30(4735)192281427(28(1822)425)4617164525121024(403)111325h815182032H71617H216H3b3019+
MFCD03183910
STK011367
ZINC000097957871
ZINC000097957872

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Available files

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