Vitas-M small molecule compound
ethyl 2-(5-bromo-2-{[(2E)-3-(furan-2-yl)prop-2-enoyl]oxy}phenyl)-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK384003
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cc(Br)ccc1OC(=O)/C=C/c1ccco1)O
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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 C25H22BrN3O6S MW 572.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN3O6S/c1-2-33-25(32)29-10-9-16-19(13-29)36-24-21(16)23(31)27-22(28-24)17-12-14(26)5-7-18(17)35-20(30)8-6-15-4-3-11-34-15/h3-8,11-12,22,28H,2,9-10,13H2,1H3,(H,27,31)/b8-6+InChIKey
KSRQAMPYKCCLOE-SOFGYWHQSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC(=C4)Br)OC(=O)C=CC5=CC=CO5CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cc(Br)ccc1OC(=O)C=Cc1ccco1)O
ethyl2(5bromo2(((2E)3(furan2yl)prop2enoyl)oxy)phenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(5bromo2((E)3(furan2yl)prop2enoyl)oxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
Registry IDs
MFCD03837180ZINC000097964022
ZINC000097964023
Check stock
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