Vitas-M small molecule compound

N-[1-(1-benzyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-fluorobenzamide

Catalog ID
STK547974
SMILES CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccc(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 C25H24FN3OS MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3OS/c1-31-16-15-22(28-25(30)19-11-13-20(26)14-12-19)24-27-21-9-5-6-10-23(21)29(24)17-18-7-3-2-4-8-18/h2-14,22H,15-17H2,1H3,(H,28,30)
InChIKey
SHBWGUUOTUGGMU-UHFFFAOYSA-N
Synonyms
750615-20-4
750615204
CSCCC(C1=NC2=CC=CC=C2N1CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)F
InChI=1SC25H24FN3OSc131161522(2825(30)19111320(26)141219)2427219561023(21)29(24)17187324818h21422H1517H21H3(H2830)
MFCD03655425
N(1(1benzyl1Hbenzimidazol2yl)3(methylsulfanyl)propyl)4fluorobenzamide
N(1(1benzyl1Hbenzo(d)imidazol2yl)3(methylthio)propyl)4fluorobenzamide
N(1(1BENZYLBENZIMIDAZOL2YL)3METHYLSULFANYLPROPYL)4FLUOROBENZAMIDE
ZINC000009375330
ZINC000009375331

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Available files

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