Vitas-M small molecule compound
ethyl 2-[5-(3-bromophenyl)furan-2-yl]-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK384059
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(o1)c1cccc(c1)Br)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 C22H20BrN3O4S MW 502.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4S/c1-2-29-22(28)26-9-8-14-17(11-26)31-21-18(14)20(27)24-19(25-21)16-7-6-15(30-16)12-4-3-5-13(23)10-12/h3-7,10,19,25H,2,8-9,11H2,1H3,(H,24,27)InChIKey
NDEIABVNBJCRLO-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(O4)C5=CC(=CC=C5)Br
ethyl2(5(3bromophenyl)furan2yl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(5(3bromophenyl)furan2yl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC22H20BrN3O4Sc122922(28)26981417(1126)312118(14)20(27)2419(2521)167615(3016)1243513(23)1012h37101925H28911H21H3(H2427)
MFCD03837336
ZINC000008921668
ZINC000008921672
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