Vitas-M small molecule compound

methyl {2-[1-(4-fluorobenzyl)-5-oxopyrrolidin-3-yl]-1H-benzimidazol-1-yl}acetate

Catalog ID
STL300636
SMILES COC(=O)Cn1c(nc2c1cccc2)C1CC(=O)N(C1)Cc1ccc(cc1)F

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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 C21H20FN3O3 MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O3/c1-28-20(27)13-25-18-5-3-2-4-17(18)23-21(25)15-10-19(26)24(12-15)11-14-6-8-16(22)9-7-14/h2-9,15H,10-13H2,1H3
InChIKey
OOVRUMAUFUJHMG-UHFFFAOYSA-N
Synonyms
955431-89-7
955431897
COC(=O)CN1C2=CC=CC=C2N=C1C3CC(=O)N(C3)CC4=CC=C(C=C4)F
InChI=1SC21H20FN3O3c12820(27)132518532417(18)2321(25)151019(26)24(1215)11146816(22)9714h2915H1013H21H3
methyl(2(1(4fluorobenzyl)5oxopyrrolidin3yl)1Hbenzimidazol1yl)acetate
methyl2(2(1((4fluorophenyl)methyl)5oxopyrrolidin3yl)benzimidazol1yl)acetate
MFCD13860101
ZINC000033317581
ZINC000033317583

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Available files

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