Vitas-M small molecule compound

3-(5-chloro-2-hydroxy-4-methylphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one

Catalog ID
STK587945
SMILES CC(CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)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 C29H29ClN4O3 MW 517.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClN4O3/c1-17(2)9-11-37-21-8-4-7-20(13-21)28-25-26(22-14-23(30)18(3)12-24(22)35)32-33-27(25)29(36)34(28)16-19-6-5-10-31-15-19/h4-8,10,12-15,17,28,35H,9,11,16H2,1-3H3,(H,32,33)
InChIKey
GRGYNPLUCYHXNZ-UHFFFAOYSA-N
Synonyms
866246-57-3
3(5chloro2hydroxy4methylphenyl)4(3(3methylbutoxy)phenyl)5(pyridin3ylmethyl)45dihydropyrrolo(34c)pyrazol6(2H)one
3(5chloro2hydroxy4methylphenyl)4(3(isopentyloxy)phenyl)5(pyridin3ylmethyl)45dihydropyrrolo(34c)pyrazol6(1H)one
866246573
CC(CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c((nH)n2)c1cc(Cl)c(cc1O)C)C
CC(CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c(n(nH)2)c1cc(Cl)c(cc1O)C)C
MFCD07199714
ZINC000016971889
ZINC000016971895

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Available files

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