Vitas-M small molecule compound
ethyl 4-{[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}benzoate
Catalog ID
STK858908
SMILES CCOC(=O)c1ccc(cc1)Nc1ncnc2c1cnn2c1cccc(c1)Cl
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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 C20H16ClN5O2 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O2/c1-2-28-20(27)13-6-8-15(9-7-13)25-18-17-11-24-26(19(17)23-12-22-18)16-5-3-4-14(21)10-16/h3-12H,2H2,1H3,(H,22,23,25)InChIKey
RDZNBTXCPGUFAX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl
ethyl4((1(3chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)amino)benzoate
ethyl4((1(3chlorophenyl)pyrazolo(34d)pyrimidin4yl)amino)benzoate
ETHYL4((1(3CHLOROPHENYL)PYRAZOLO(45E)PYRIMIDIN4YL)AMINO)BENZOATE
InChI=1SC20H16ClN5O2c122820(27)136815(9713)251817112426(19(17)23122218)1653414(21)1016h312H2H21H3(H222325)
MFCD05956751
ZINC000008583050
ZINC08583050
ZINC8583050
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