Vitas-M small molecule compound

1-tert-butyl-4-{1-[2-hydroxy-3-(2-methylphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one

Catalog ID
STK884241
SMILES OC(Cn1c(nc2c1cccc2)C1CC(=O)N(C1)C(C)(C)C)COc1ccccc1C

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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 C25H31N3O3 MW 421.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O3/c1-17-9-5-8-12-22(17)31-16-19(29)15-27-21-11-7-6-10-20(21)26-24(27)18-13-23(30)28(14-18)25(2,3)4/h5-12,18-19,29H,13-16H2,1-4H3
InChIKey
KXZWYERJTYZDCI-UHFFFAOYSA-N
Synonyms
1018127-14-4
1(TERTBUTYL)4(1(2HYDROXY3(2METHYLPHENOXY)PROPYL)BENZIMIDAZOL2YL)PYRROLIDIN2ONE
1(TERTBUTYL)4(1(2HYDROXY3(OTOLYLOXY)PROPYL)1HBENZO(D)IMIDAZOL2YL)PYRROLIDIN2ONE
1018127144
1tertbutyl4(1(2hydroxy3(2methylphenoxy)propyl)1Hbenzimidazol2yl)pyrrolidin2one
1tertbutyl4(1(2hydroxy3(2methylphenoxy)propyl)benzimidazol2yl)pyrrolidin2one
CC1=CC=CC=C1OCC(CN2C3=CC=CC=C3N=C2C4CC(=O)N(C4)C(C)(C)C)O
InChI=1SC25H31N3O3c1179581222(17)311619(29)15272111761020(21)2624(27)181323(30)28(1418)25(23)4h512181929H1316H214H3
MFCD12548305
ZINC000016903654
ZINC000016903660

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Available files

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