Vitas-M small molecule compound
2-bromo-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-6-methoxyphenyl 4-methylbenzoate
Catalog ID
STK746075
SMILES COc1cc(cc(c1OC(=O)c1ccc(cc1)C)Br)C1N=C(O)c2c(N1)sc1c2CCN(C1)C
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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 C25H24BrN3O4S MW 542.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O4S/c1-13-4-6-14(7-5-13)25(31)33-21-17(26)10-15(11-18(21)32-3)22-27-23(30)20-16-8-9-29(2)12-19(16)34-24(20)28-22/h4-7,10-11,22,28H,8-9,12H2,1-3H3,(H,27,30)InChIKey
MLGRNVFVKOPRMP-UHFFFAOYSA-NSynonyms
353462-39-2(2bromo6methoxy4(7methyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)4methylbenzoate
2bromo4(4hydroxy7methyl125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)6methoxyphenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C3NC4=C(C5=C(S4)CN(CC5)C)C(=O)N3)OC
Registry IDs
MFCD03794012ZINC000008448836
ZINC000008448837
Check stock
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Check stock on Vitas-MAvailable files
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