Vitas-M small molecule compound
3-{[1-ethyl-3-methyl-5-(propan-2-yl)-1H-pyrazolo[4,3-d]pyrimidin-7-yl]amino}benzonitrile
Catalog ID
STL258269
SMILES N#Cc1cccc(c1)Nc1nc(nc2c1n(CC)nc2C)C(C)C
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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 C18H20N6 MW 320.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6/c1-5-24-16-15(12(4)23-24)21-17(11(2)3)22-18(16)20-14-8-6-7-13(9-14)10-19/h6-9,11H,5H2,1-4H3,(H,20,21,22)InChIKey
XIAUWPKURNTDBY-UHFFFAOYSA-NSynonyms
3((1ethyl3methyl5(propan2yl)1Hpyrazolo(43d)pyrimidin7yl)amino)benzonitrile
3((1ethyl3methyl5propan2ylpyrazolo(43d)pyrimidin7yl)amino)benzonitrile
CCN1C2=C(C(=N1)C)N=C(N=C2NC3=CC=CC(=C3)C#N)C(C)C
InChI=1SC18H20N6c15241615(12(4)2324)2117(11(2)3)2218(16)201486713(914)1019h6911H5H214H3(H202122)
MFCD24851527
ZINC000072238358
ZINC72238358
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