Vitas-M small molecule compound
ethyl 2-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK383763
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cc(OC)c(c(c1Br)Br)O)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 C19H19Br2N3O5S MW 561.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Br2N3O5S/c1-3-29-19(27)24-5-4-8-11(7-24)30-18-12(8)17(26)22-16(23-18)9-6-10(28-2)15(25)14(21)13(9)20/h6,16,23,25H,3-5,7H2,1-2H3,(H,22,26)InChIKey
WTHQCWWMSPIDKY-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C(=C4Br)Br)O)OC
ethyl2(23dibromo4hydroxy5methoxyphenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(23dibromo4hydroxy5methoxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC19H19Br2N3O5Sc132919(27)2454811(724)301812(8)17(26)2216(2318)9610(282)15(25)14(21)13(9)20h6162325H357H212H3(H2226)
MFCD11853246
ZINC000102155416
ZINC000102155421
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