Vitas-M small molecule compound

1-[(1-butyl-5-chloro-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]octahydroquinolin-4(1H)-one

Catalog ID
STL400333
SMILES CCCCn1nc(c2c1nc(C)c(c2C(=O)N1CCC(=O)C2C1CCCC2)Cl)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 C22H29ClN4O2 MW 416.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29ClN4O2/c1-4-5-11-27-21-18(13(2)25-27)19(20(23)14(3)24-21)22(29)26-12-10-17(28)15-8-6-7-9-16(15)26/h15-16H,4-12H2,1-3H3
InChIKey
CKGYSSKGVPPEQF-UHFFFAOYSA-N
Synonyms
938017-86-8
1((1butyl5chloro36dimethyl1Hpyrazolo(34b)pyridin4yl)carbonyl)octahydroquinolin4(1H)one
1(1butyl5chloro36dimethylpyrazolo(34b)pyridine4carbonyl)234a56788aoctahydroquinolin4one
938017868
CCCCN1C2=NC(=C(C(=C2C(=N1)C)C(=O)N3CCC(=O)C4C3CCCC4)Cl)C
InChI=1SC22H29ClN4O2c14511272118(13(2)2527)19(20(23)14(3)2421)22(29)26121017(28)15867916(15)26h1516H412H213H3
MFCD08555797
ZINC000020607437
ZINC000020607440

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Available files

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