Vitas-M small molecule compound
ethyl (2E)-2-(2-bromo-4,5-dimethoxybenzylidene)-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK675233
SMILES CCOC(=O)C1=C(N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)/c(=C\c1cc(OC)c(cc1Br)OC)/s2)c1ccccc1
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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 C35H29BrN2O6S MW 685.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29BrN2O6S/c1-5-44-34(40)30-31(21-12-7-6-8-13-21)37-35-38(32(30)29-23-14-10-9-11-20(23)15-16-25(29)41-2)33(39)28(45-35)18-22-17-26(42-3)27(43-4)19-24(22)36/h6-19,32H,5H2,1-4H3/b28-18+InChIKey
ZFXVWWSRZDVXAB-MTDXEUNCSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)c(=Cc1cc(OC)c(cc1Br)OC)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC4=CC=CC=C43)OC)C(=O)C(=CC5=CC(=C(C=C5Br)OC)OC)S2)C6=CC=CC=C6
ETHYL(2E)2((2BROMO45DIMETHOXYPHENYL)METHYLIDENE)5(2METHOXYNAPHTHALEN1YL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)2(2bromo45dimethoxybenzylidene)5(2methoxynaphthalen1yl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(2BROMO45DIMETHOXYBENZYLIDENE)5(2METHOXY1NAPHTHYL)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC35H29BrN2O6Sc154434(40)3031(21127681321)373538(32(30)2923141091120(23)151625(29)412)33(39)28(4535)18221726(423)27(434)1924(22)36h61932H5H214H3b2818+
MFCD01571691
ZINC000008425435
ZINC000008425437
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