Vitas-M small molecule compound

1-(3-methoxyphenyl)-4-(1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-benzimidazol-2-yl)pyrrolidin-2-one

Catalog ID
STK825118
SMILES C=CCc1ccccc1OCCn1c(nc2c1cccc2)C1CC(=O)N(C1)c1cccc(c1)OC

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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 C29H29N3O3 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O3/c1-3-9-21-10-4-7-15-27(21)35-17-16-31-26-14-6-5-13-25(26)30-29(31)22-18-28(33)32(20-22)23-11-8-12-24(19-23)34-2/h3-8,10-15,19,22H,1,9,16-18,20H2,2H3
InChIKey
ARATXIGCYHOBTK-UHFFFAOYSA-N
Synonyms
912889-37-3
1(3methoxyphenyl)4(1(2(2(prop2en1yl)phenoxy)ethyl)1Hbenzimidazol2yl)pyrrolidin2one
1(3METHOXYPHENYL)4(1(2(2PROP2ENYLPHENOXY)ETHYL)BENZIMIDAZOL2YL)PYRROLIDIN2ONE
4(1(2(2ALLYLPHENOXY)ETHYL)1HBENZO(D)IMIDAZOL2YL)1(3METHOXYPHENYL)PYRROLIDIN2ONE
912889373
COC1=CC=CC(=C1)N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCOC5=CC=CC=C5CC=C
InChI=1SC29H29N3O3c1392110471527(21)351716312614651325(26)3029(31)221828(33)32(2022)231181224(1923)342h3810151922H19161820H22H3
MFCD09759501
ZINC000027792656
ZINC000027792659

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Available files

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