Vitas-M small molecule compound

methyl N-{[1-(2-methyl-1H-indol-3-yl)-3-oxo-1,3-dihydro-2H-isoindol-2-yl]acetyl}glycinate

Catalog ID
STK166480
SMILES COC(=O)CNC(=O)CN1C(=O)c2c(C1c1c(C)[nH]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 C22H21N3O4 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4/c1-13-20(16-9-5-6-10-17(16)24-13)21-14-7-3-4-8-15(14)22(28)25(21)12-18(26)23-11-19(27)29-2/h3-10,21,24H,11-12H2,1-2H3,(H,23,26)
InChIKey
XYMKSWSCPUGICI-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1)C3C4=CC=CC=C4C(=O)N3CC(=O)NCC(=O)OC
COC(=O)CNC(=O)CN1C(=O)c2c(C1c1c(C)(nH)c3c1cccc3)cccc2
InChI=1SC22H21N3O4c11320(169561017(16)2413)2114734815(14)22(28)25(21)1218(26)231119(27)292h3102124H1112H212H3(H2326)
METHYL2((2(1(2METHYL1HINDOL3YL)3OXO1HISOINDOL2YL)ACETYL)AMINO)ACETATE
METHYLN((1(2METHYL1HINDOL3YL)3OXO13DIHYDRO2HISOINDOL2YL)ACETYL)GLYCINATE
MFCD08674225
ZINC000004702690
ZINC000004702691

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Available files

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