Vitas-M small molecule compound

2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl 2-(3-methoxypropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK264111
SMILES COCCCN1C(=O)c2c(C1=O)cc(cc2)C(=O)OCC(=O)Nc1ccc(c(c1)Cl)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 C22H21ClN2O6 MW 444.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O6/c1-13-4-6-15(11-18(13)23)24-19(26)12-31-22(29)14-5-7-16-17(10-14)21(28)25(20(16)27)8-3-9-30-2/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,24,26)
InChIKey
WEALBXMSBMHHQR-UHFFFAOYSA-N
Synonyms

(2(3CHLORO4METHYLANILINO)2OXOETHYL)2(3METHOXYPROPYL)13DIOXOISOINDOLE5CARBOXYLATE
2((3CHLORO4METHYLPHENYL)AMINO)2OXOETHYL2(3METHOXYPROPYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC)Cl
InChI=1SC22H21ClN2O6c1134615(1118(13)23)2419(26)123122(29)14571617(1014)21(28)25(20(16)27)839302h471011H38912H212H3(H2426)
MFCD06179438
ZINC000001973311
ZINC01973311
ZINC1973311

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Available files

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