Vitas-M small molecule compound
1-(2,5-dimethylbenzyl)-3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK272790
SMILES Cc1ccc(c(c1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc2c(c1)CCCC2)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 C29H29NO3 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO3/c1-19-11-12-20(2)24(15-19)18-30-26-10-6-5-9-25(26)29(33,28(30)32)17-27(31)23-14-13-21-7-3-4-8-22(21)16-23/h5-6,9-16,33H,3-4,7-8,17-18H2,1-2H3InChIKey
KEQGRVXOSQAORA-UHFFFAOYSA-NSynonyms
1((25dimethylphenyl)methyl)3hydroxy3(2oxo2(5678tetrahydronaphthalen2yl)ethyl)indol2one
1(25dimethylbenzyl)3hydroxy3(2oxo2(5678tetrahydronaphthalen2yl)ethyl)13dihydro2Hindol2one
CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC5=C(CCCC5)C=C4)O
InChI=1SC29H29NO3c119111220(2)24(1519)1830261065925(26)29(3328(30)32)1727(31)23141321734822(21)1623h5691633H34781718H212H3
MFCD04042342
ZINC000008927833
ZINC000008927836
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