Vitas-M small molecule compound
ethyl (2Z)-2-(3-bromo-4,5-dimethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK523805
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cc(Br)c(c(c1)OC)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 C26H25BrN2O6S MW 573.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN2O6S/c1-6-35-25(31)21-14(2)28-26-29(22(21)16-7-9-17(32-3)10-8-16)24(30)20(36-26)13-15-11-18(27)23(34-5)19(12-15)33-4/h7-13,22H,6H2,1-5H3/b20-13-InChIKey
VAGATPPQJOLDHM-MOSHPQCFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cc(Br)c(c(c1)OC)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC(=C(C(=C4)Br)OC)OC)S2)C
ETHYL(2Z)2((3BROMO45DIMETHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3bromo45dimethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H25BrN2O6Sc163525(31)2114(2)282629(22(21)167917(323)10816)24(30)20(3626)13151118(27)23(345)19(1215)334h71322H6H215H3b2013
MFCD01592540
ZINC000003667577
ZINC000003667579
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