Vitas-M small molecule compound

3-[2-(3-methoxyphenyl)-1H-indol-3-yl]-2-(1-phenylethyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one

Catalog ID
STK213068
SMILES COc1cccc(c1)c1[nH]c2c(c1C1C3=C(C(=O)N1C(c1ccccc1)C)CCCC3)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 C31H30N2O2 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O2/c1-20(21-11-4-3-5-12-21)33-30(24-15-6-7-16-25(24)31(33)34)28-26-17-8-9-18-27(26)32-29(28)22-13-10-14-23(19-22)35-2/h3-5,8-14,17-20,30,32H,6-7,15-16H2,1-2H3
InChIKey
LTAUVZGPOPUSSF-UHFFFAOYSA-N
Synonyms

3(2(3methoxyphenyl)1Hindol3yl)2(1phenylethyl)234567hexahydro1Hisoindol1one
3(2(3methoxyphenyl)1Hindol3yl)2(1phenylethyl)4567tetrahydro3Hisoindol1one
CC(C1=CC=CC=C1)N2C(C3=C(C2=O)CCCC3)C4=C(NC5=CC=CC=C54)C6=CC(=CC=C6)OC
COc1cccc(c1)c1(nH)c2c(c1C1C3=C(C(=O)N1C(c1ccccc1)C)CCCC3)cccc2
InChI=1SC31H30N2O2c120(21114351221)3330(2415671625(24)31(33)34)282617891827(26)3229(28)2213101423(1922)352h3581417203032H671516H212H3
MFCD08680471
ZINC000010058895
ZINC000010058898

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Available files

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