Vitas-M small molecule compound

N-[3-(1H-benzimidazol-2-yl)-1-benzyl-4,5-dimethyl-1H-pyrrol-2-yl]-3-methylbutanamide

Catalog ID
STL350542
SMILES CC(CC(=O)Nc1c(c2nc3c([nH]2)cccc3)c(c(n1Cc1ccccc1)C)C)C

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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 C25H28N4O MW 400.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O/c1-16(2)14-22(30)28-25-23(24-26-20-12-8-9-13-21(20)27-24)17(3)18(4)29(25)15-19-10-6-5-7-11-19/h5-13,16H,14-15H2,1-4H3,(H,26,27)(H,28,30)
InChIKey
CPOYDZPDMKSFDG-UHFFFAOYSA-N
Synonyms
929834-04-8
929834048
CC(CC(=O)Nc1c(c2nc3c((nH)2)cccc3)c(c(n1Cc1ccccc1)C)C)C
CC1=C(N(C(=C1C2=NC3=CC=CC=C3N2)NC(=O)CC(C)C)CC4=CC=CC=C4)C
InChI=1SC25H28N4Oc116(2)1422(30)282523(24262012891321(20)2724)17(3)18(4)29(25)1519106571119h51316H1415H214H3(H2627)(H2830)
MFCD09847253
N(3(1Hbenzimidazol2yl)1benzyl45dimethyl1Hpyrrol2yl)3methylbutanamide
N(3(1Hbenzimidazol2yl)1benzyl45dimethylpyrrol2yl)3methylbutanamide
N(3(1Hbenzo(d)imidazol2yl)1benzyl45dimethyl1Hpyrrol2yl)3methylbutanamide
ZINC000009421687
ZINC09421687
ZINC9421687

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Available files

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