Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-(3-phenoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798125
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C/c1cccc(c1)Oc1ccccc1)/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 C32H28N2O7S MW 584.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O7S/c1-5-39-31(37)28-19(2)33-32-34(29(28)22-14-15-25(40-20(3)35)26(18-22)38-4)30(36)27(42-32)17-21-10-9-13-24(16-21)41-23-11-7-6-8-12-23/h6-18,29H,5H2,1-4H3/b27-17-InChIKey
BZSIJMHSFQQFDM-PKAZHMFMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1cccc(c1)Oc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=CC4=CC(=CC=C4)OC5=CC=CC=C5)S2)C
ethyl(2Z)5(4(acetyloxy)3methoxyphenyl)7methyl3oxo2(3phenoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)7METHYL3OXO2((3PHENOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H28N2O7Sc153931(37)2819(2)333234(29(28)22141525(4020(3)35)26(1822)384)30(36)27(4232)17211091324(1621)4123117681223h61829H5H214H3b2717
MFCD03461870
ZINC000002709266
ZINC000002709270
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.