Vitas-M small molecule compound
methyl 3-hydroxy-5-[1-methyl-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-5-yl]-5H-pyrazolo[4,3-c]pyridine-7-carboxylate
Catalog ID
STL494511
SMILES COC(=O)c1cn(cc2c1nnc2O)c1ccc2c(c1)nc(n2C)CN1CCCC1
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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 C21H22N6O3 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3/c1-25-17-6-5-13(9-16(17)22-18(25)12-26-7-3-4-8-26)27-10-14-19(23-24-20(14)28)15(11-27)21(29)30-2/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,24,28)InChIKey
QUGQCAIXQOTOKW-UHFFFAOYSA-NSynonyms
CN1C2=C(C=C(C=C2)N3C=C4C(=NNC4=O)C(=C3)C(=O)OC)N=C1CN5CCCC5
InChI=1SC21H22N6O3c125176513(916(17)2218(25)1226734826)27101419(232420(14)28)15(1127)21(29)302h56911H347812H212H3(H2428)
methyl3hydroxy5(1methyl2(pyrrolidin1ylmethyl)1Hbenzimidazol5yl)5Hpyrazolo(43c)pyridine7carboxylate
methyl5(1methyl2(pyrrolidin1ylmethyl)benzimidazol5yl)3oxo2Hpyrazolo(43c)pyridine7carboxylate
MFCD30716452
ZINC000253412373
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