Vitas-M small molecule compound
ethyl 5-[2-(4-ethoxy-4-oxobutyl)-1-methyl-1H-benzimidazol-5-yl]-3-hydroxy-5H-pyrazolo[4,3-c]pyridine-7-carboxylate
Catalog ID
STL492238
SMILES CCOC(=O)CCCc1nc2c(n1C)ccc(c2)n1cc(C(=O)OCC)c2c(c1)c(O)nn2
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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 C23H25N5O5 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O5/c1-4-32-20(29)8-6-7-19-24-17-11-14(9-10-18(17)27(19)3)28-12-15-21(25-26-22(15)30)16(13-28)23(31)33-5-2/h9-13H,4-8H2,1-3H3,(H,26,30)InChIKey
SOCGVZZWRCROCS-UHFFFAOYSA-NSynonyms
CCOC(=O)CCCC1=NC2=C(N1C)C=CC(=C2)N3C=C4C(=NNC4=O)C(=C3)C(=O)OCC
ethyl5(2(4ethoxy4oxobutyl)1methyl1Hbenzimidazol5yl)3hydroxy5Hpyrazolo(43c)pyridine7carboxylate
ethyl5(2(4ethoxy4oxobutyl)1methylbenzimidazol5yl)3oxo2Hpyrazolo(43c)pyridine7carboxylate
InChI=1SC23H25N5O5c143220(29)8671924171114(91018(17)27(19)3)28121521(252622(15)30)16(1328)23(31)3352h913H48H213H3(H2630)
MFCD30715010
ZINC000253412935
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