Vitas-M small molecule compound
ethyl 2-[2-(benzyloxy)-5-bromophenyl]-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK384064
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cc(Br)ccc1OCc1ccccc1)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 C25H24BrN3O4S MW 542.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O4S/c1-2-32-25(31)29-11-10-17-20(13-29)34-24-21(17)23(30)27-22(28-24)18-12-16(26)8-9-19(18)33-14-15-6-4-3-5-7-15/h3-9,12,22,28H,2,10-11,13-14H2,1H3,(H,27,30)InChIKey
ZYDIXFCHNZUHJT-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC(=C4)Br)OCC5=CC=CC=C5
ethyl2(2(benzyloxy)5bromophenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(5bromo2phenylmethoxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC25H24BrN3O4Sc123225(31)2911101720(1329)342421(17)23(30)2722(2824)181216(26)8919(18)3314156435715h39122228H210111314H21H3(H2730)
MFCD03837342
ZINC000102093897
ZINC000102093900
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