Vitas-M small molecule compound

4-{1-[2-(3-methoxyphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-(4-methylphenyl)pyrrolidin-2-one

Catalog ID
STK825087
SMILES COc1cccc(c1)OCCn1c(nc2c1cccc2)C1CC(=O)N(C1)c1ccc(cc1)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 C27H27N3O3 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3/c1-19-10-12-21(13-11-19)30-18-20(16-26(30)31)27-28-24-8-3-4-9-25(24)29(27)14-15-33-23-7-5-6-22(17-23)32-2/h3-13,17,20H,14-16,18H2,1-2H3
InChIKey
KFTKVKLWDUZYNY-UHFFFAOYSA-N
Synonyms
912889-67-9
4(1(2(3METHOXYPHENOXY)ETHYL)1HBENZIMIDAZOL2YL)1(4METHYLPHENYL)2PYRROLIDINONE
4(1(2(3methoxyphenoxy)ethyl)1Hbenzimidazol2yl)1(4methylphenyl)pyrrolidin2one
4(1(2(3METHOXYPHENOXY)ETHYL)1HBENZO(D)IMIDAZOL2YL)1(PTOLYL)PYRROLIDIN2ONE
4(1(2(3METHOXYPHENOXY)ETHYL)BENZIMIDAZOL2YL)1(4METHYLPHENYL)PYRROLIDIN2ONE
912889679
CC1=CC=C(C=C1)N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCOC5=CC=CC(=C5)OC
InChI=1SC27H27N3O3c119101221(131119)301820(1626(30)31)272824834925(24)29(27)1415332375622(1723)322h3131720H141618H212H3
MFCD09759511
ZINC000012062151
ZINC000012062152

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.