Vitas-M small molecule compound

4-{1-[2-(3,4-dimethylphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one

Catalog ID
STK825120
SMILES COc1cccc(c1)N1CC(CC1=O)c1nc2c(n1CCOc1ccc(c(c1)C)C)cccc2

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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 C28H29N3O3 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3/c1-19-11-12-24(15-20(19)2)34-14-13-30-26-10-5-4-9-25(26)29-28(30)21-16-27(32)31(18-21)22-7-6-8-23(17-22)33-3/h4-12,15,17,21H,13-14,16,18H2,1-3H3
InChIKey
VRFABFLUPWFRSS-UHFFFAOYSA-N
Synonyms
912903-16-3
4(1(2(34dimethylphenoxy)ethyl)1Hbenzimidazol2yl)1(3methoxyphenyl)pyrrolidin2one
4(1(2(34DIMETHYLPHENOXY)ETHYL)1HBENZO(D)IMIDAZOL2YL)1(3METHOXYPHENYL)PYRROLIDIN2ONE
4(1(2(34DIMETHYLPHENOXY)ETHYL)BENZIMIDAZOL2YL)1(3METHOXYPHENYL)PYRROLIDIN2ONE
912903163
CC1=C(C=C(C=C1)OCCN2C3=CC=CC=C3N=C2C4CC(=O)N(C4)C5=CC(=CC=C5)OC)C
InChI=1SC28H29N3O3c119111224(1520(19)2)34141330261054925(26)2928(30)211627(32)31(1821)2276823(1722)333h412151721H13141618H213H3
MFCD09759498
ZINC000016902467
ZINC000016902469

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Available files

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