Vitas-M small molecule compound

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

Catalog ID
STK249458
SMILES C=CCN1C(=O)C2=C(C1c1c([nH]c3c1cccc3)c1cccc(c1)OC)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 C26H26N2O2 MW 398.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2/c1-3-15-28-25(19-11-4-5-12-20(19)26(28)29)23-21-13-6-7-14-22(21)27-24(23)17-9-8-10-18(16-17)30-2/h3,6-10,13-14,16,25,27H,1,4-5,11-12,15H2,2H3
InChIKey
CJLXFHYFHJJWOY-UHFFFAOYSA-N
Synonyms

3(2(3methoxyphenyl)1Hindol3yl)2(prop2en1yl)234567hexahydro1Hisoindol1one
3(2(3methoxyphenyl)1Hindol3yl)2prop2enyl4567tetrahydro3Hisoindol1one
C=CCN1C(=O)C2=C(C1c1c((nH)c3c1cccc3)c1cccc(c1)OC)CCCC2
COC1=CC=CC(=C1)C2=C(C3=CC=CC=C3N2)C4C5=C(CCCC5)C(=O)N4CC=C
InChI=1SC26H26N2O2c13152825(1911451220(19)26(28)29)232113671422(21)2724(23)17981018(1617)302h36101314162527H145111215H22H3
MFCD08681016
ZINC000009668424
ZINC000009668425

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Available files

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