Vitas-M small molecule compound
2-methylpropyl 4-({5-[6-amino-5-cyano-3-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxybenzyl}oxy)benzoate
Catalog ID
STK496808
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1)C(=O)OCC(C)C)OC)c(n[nH]2)c1ccc2c(c1)cccc2
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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 C36H32N4O5 MW 600.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32N4O5/c1-21(2)19-44-36(41)23-10-13-28(14-11-23)43-20-27-17-25(12-15-30(27)42-3)31-29(18-37)34(38)45-35-32(31)33(39-40-35)26-9-8-22-6-4-5-7-24(22)16-26/h4-17,21,31H,19-20,38H2,1-3H3,(H,39,40)InChIKey
UVAULULBCRDJQR-UHFFFAOYSA-NSynonyms
667404-79-72methylpropyl4((5(6amino5cyano3(naphthalen2yl)14dihydropyrano(23c)pyrazol4yl)2methoxybenzyl)oxy)benzoate
2methylpropyl4((5(6amino5cyano3naphthalen2yl24dihydropyrano(23c)pyrazol4yl)2methoxyphenyl)methoxy)benzoate
667404797
CC(C)COC(=O)C1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3C(=C(OC4=NNC(=C34)C5=CC6=CC=CC=C6C=C5)N)C#N)OC
InChI=1SC36H32N4O5c121(2)194436(41)23101328(141123)4320271725(121530(27)423)3129(1837)34(38)453532(31)33(394035)269822645724(22)1626h4172131H192038H213H3(H3940)
MFCD03341681
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1)C(=O)OCC(C)C)OC)c(n(nH)2)c1ccc2c(c1)cccc2
ZINC000097948738
ZINC000097948739
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.