Vitas-M small molecule compound
2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl 1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK264112
SMILES O=C(Nc1ccc(c(c1)Cl)C)COC(=O)c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1
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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 C23H21ClN2O6 MW 456.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O6/c1-13-4-6-15(10-19(13)24)25-20(27)12-32-23(30)14-5-7-17-18(9-14)22(29)26(21(17)28)11-16-3-2-8-31-16/h4-7,9-10,16H,2-3,8,11-12H2,1H3,(H,25,27)InChIKey
ZOIQUBFBSUOFOJ-UHFFFAOYSA-NSynonyms
(2(3chloro4methylanilino)2oxoethyl)13dioxo2(oxolan2ylmethyl)isoindole5carboxylate
2((3chloro4methylphenyl)amino)2oxoethyl13dioxo2(tetrahydrofuran2ylmethyl)23dihydro1Hisoindole5carboxylate
CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4)Cl
InChI=1SC23H21ClN2O6c1134615(1019(13)24)2520(27)123223(30)14571718(914)22(29)26(21(17)28)11163283116h4791016H2381112H21H3(H2527)
MFCD06179659
ZINC000009489335
ZINC000009489336
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