Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-2-(3-bromobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK534725
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C\c1cccc(c1)Br)/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 C27H25BrN2O6S MW 585.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O6S/c1-5-34-21-14-18(10-11-20(21)36-16(4)31)24-23(26(33)35-6-2)15(3)29-27-30(24)25(32)22(37-27)13-17-8-7-9-19(28)12-17/h7-14,24H,5-6H2,1-4H3/b22-13+InChIKey
USGFZWBVVYKKIB-LPYMAVHISA-NSynonyms
(E)ethyl5(4acetoxy3ethoxyphenyl)2(3bromobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)c(=Cc1cccc(c1)Br)s2
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=CC=C4)Br)S3)C)C(=O)OCC)OC(=O)C
ethyl(2E)5(4(acetyloxy)3ethoxyphenyl)2(3bromobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3ethoxyphenyl)2((3bromophenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC27H25BrN2O6Sc1534211418(101120(21)3616(4)31)2423(26(33)3562)15(3)292730(24)25(32)22(3727)131787919(28)1217h71424H56H214H3b2213+
MFCD01943413
ZINC000097966489
ZINC000097966490
Check stock
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Check stock on Vitas-MAvailable files
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