Vitas-M small molecule compound

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

Catalog ID
STK816991
SMILES CCOc1cc(ccc1OCC)C1C(=C(C)N=C2N1C(=O)C(S2)CC)C(=O)OC

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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 C21H26N2O5S MW 418.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O5S/c1-6-16-19(24)23-18(17(20(25)26-5)12(4)22-21(23)29-16)13-9-10-14(27-7-2)15(11-13)28-8-3/h9-11,16,18H,6-8H2,1-5H3
InChIKey
LYKCAXGWELYYDI-UHFFFAOYSA-N
Synonyms
620552-78-5
620552785
CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OC)C3=CC(=C(C=C3)OCC)OCC
InChI=1SC21H26N2O5Sc161619(24)2318(17(20(25)265)12(4)2221(23)2916)1391014(2772)15(1113)2883h9111618H68H215H3
METHYL(2R5R)5(34DIETHOXYPHENYL)2ETHYL7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL(2S5R)5(34DIETHOXYPHENYL)2ETHYL7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL(2S5S)5(34DIETHOXYPHENYL)2ETHYL7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl5(34diethoxyphenyl)2ethyl7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL5(34DIETHOXYPHENYL)2ETHYL7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD04446192
ZINC000002487153
ZINC000002487158

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Available files

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