Vitas-M small molecule compound
3-[2-(3-methoxyphenyl)-1-methyl-1H-indol-3-yl]-2-(3-methylbutyl)-2,3-dihydro-1H-isoindol-1-one
Catalog ID
STK282254
SMILES COc1cccc(c1)c1n(C)c2c(c1C1N(CCC(C)C)C(=O)c3c1cccc3)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 C29H30N2O2 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O2/c1-19(2)16-17-31-28(22-12-5-6-13-23(22)29(31)32)26-24-14-7-8-15-25(24)30(3)27(26)20-10-9-11-21(18-20)33-4/h5-15,18-19,28H,16-17H2,1-4H3InChIKey
NCMPNOIVXFBJOT-UHFFFAOYSA-NSynonyms
3(2(3methoxyphenyl)1methyl1Hindol3yl)2(3methylbutyl)23dihydro1Hisoindol1one
3(2(3methoxyphenyl)1methylindol3yl)2(3methylbutyl)3Hisoindol1one
CC(C)CCN1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC(=CC=C5)OC
InChI=1SC29H30N2O2c119(2)16173128(2212561323(22)29(31)32)262414781525(24)30(3)27(26)201091121(1820)334h515181928H1617H214H3
MFCD09270324
ZINC000013942498
ZINC000013942499
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