Vitas-M small molecule compound
ethyl (2E)-2-(2-bromo-4,5-dimethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK331979
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)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 C25H23BrN2O5S MW 543.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN2O5S/c1-5-33-24(30)21-14(2)27-25-28(22(21)15-9-7-6-8-10-15)23(29)20(34-25)12-16-11-18(31-3)19(32-4)13-17(16)26/h6-13,22H,5H2,1-4H3/b20-12+InChIKey
RIGHPBPNNWGZQJ-UDWIEESQSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cc(OC)c(cc1Br)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C=C4Br)OC)OC)S2)C
ETHYL(2E)2((2BROMO45DIMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)2(2bromo45dimethoxybenzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23BrN2O5Sc153324(30)2114(2)272528(22(21)1597681015)23(29)20(3425)12161118(313)19(324)1317(16)26h61322H5H214H3b2012+
MFCD01155306
ZINC000100065764
ZINC000100065767
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