Vitas-M small molecule compound

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

Catalog ID
STK073105
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1cc(Cl)ccc1OCCOCCOc1ccc(cc1)C)/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 C36H37ClN2O8S MW 693.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H37ClN2O8S/c1-6-45-35(41)32-23(3)38-36-39(33(32)24-9-13-29(42-4)30(20-24)43-5)34(40)31(48-36)21-25-19-26(37)10-14-28(25)47-18-16-44-15-17-46-27-11-7-22(2)8-12-27/h7-14,19-21,33H,6,15-18H2,1-5H3/b31-21+
InChIKey
MJTHLZLPRHSYHP-NJZRLIGZSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cc(Cl)ccc1OCCOCCOc1ccc(cc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=C(C=CC(=C4)Cl)OCCOCCOC5=CC=C(C=C5)C)S2)C
ethyl(2E)2((5chloro2(2(2(4methylphenoxy)ethoxy)ethoxy)phenyl)methylidene)5(34dimethoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2(5CHLORO2(2(2(4METHYLPHENOXY)ETHOXY)ETHOXY)BENZYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC36H37ClN2O8Sc164535(41)3223(3)383639(33(32)2491329(424)30(2024)435)34(40)31(4836)21251926(37)101428(25)471816441517462711722(2)81227h714192133H61518H215H3b3121+
MFCD02201954
STK073105
ZINC000097958968
ZINC000097958969

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Available files

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