Vitas-M small molecule compound

N-tert-butyl-3-{[(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}benzamide

Catalog ID
STK299554
SMILES O=C(CN1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])Nc1cccc(c1)C(=O)NC(C)(C)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 C21H20N4O6 MW 424.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O6/c1-21(2,3)23-18(27)12-5-4-6-13(9-12)22-17(26)11-24-19(28)15-8-7-14(25(30)31)10-16(15)20(24)29/h4-10H,11H2,1-3H3,(H,22,26)(H,23,27)
InChIKey
UYMRPOOQKYDXOW-UHFFFAOYSA-N
Synonyms

CC(C)(C)NC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O)
InChI=1SC21H20N4O6c121(23)2318(27)1254613(912)2217(26)112419(28)158714(25(30)31)1016(15)20(24)29h410H11H213H3(H2226)(H2327)
MFCD01973971
Ntertbutyl3(((5nitro13dioxo13dihydro2Hisoindol2yl)acetyl)amino)benzamide
NTERTBUTYL3((2(5NITRO13DIOXOISOINDOL2YL)ACETYL)AMINO)BENZAMIDE
O=C(CN1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O))Nc1cccc(c1)C(=O)NC(C)(C)C
ZINC000001175057
ZINC01175057
ZINC1175057

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Available files

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