Vitas-M small molecule compound
N-(2-methyl-3-nitrophenyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxamide
Catalog ID
STK296253
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1)Nc1cccc(c1C)[N+](=O)[O-]
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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 C21H19N3O6 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6/c1-12-17(5-2-6-18(12)24(28)29)22-19(25)13-7-8-15-16(10-13)21(27)23(20(15)26)11-14-4-3-9-30-14/h2,5-8,10,14H,3-4,9,11H2,1H3,(H,22,25)InChIKey
RMNAWKBHSPOVHJ-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1(N+)(=O)(O))NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4
InChI=1SC21H19N3O6c11217(52618(12)24(28)29)2219(25)13781516(1013)21(27)23(20(15)26)11144393014h2581014H34911H21H3(H2225)
MFCD07629594
N(2methyl3nitrophenyl)13dioxo2(oxolan2ylmethyl)isoindole5carboxamide
N(2methyl3nitrophenyl)13dioxo2(tetrahydrofuran2ylmethyl)23dihydro1Hisoindole5carboxamide
O=C(c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1)Nc1cccc(c1C)(N+)(=O)(O)
ZINC000013955109
ZINC000013955111
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