Vitas-M small molecule compound
ethyl (2Z)-2-(2-bromo-4,5-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522583
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cc(OC)c(cc1Br)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 C27H27BrN2O7S MW 603.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN2O7S/c1-7-37-26(32)23-14(2)29-27-30(24(23)15-8-9-18(33-3)19(10-15)34-4)25(31)22(38-27)12-16-11-20(35-5)21(36-6)13-17(16)28/h8-13,24H,7H2,1-6H3/b22-12-InChIKey
SMNRSUVYAUPXIV-UUYOSTAYSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cc(OC)c(cc1Br)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=CC(=C(C=C4Br)OC)OC)S2)C
ETHYL(2Z)2((2BROMO45DIMETHOXYPHENYL)METHYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(2bromo45dimethoxybenzylidene)5(34dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC27H27BrN2O7Sc173726(32)2314(2)292730(24(23)158918(333)19(1015)344)25(31)22(3827)12161120(355)21(366)1317(16)28h81324H7H216H3b2212
MFCD02378686
ZINC000006545030
ZINC000006545034
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