Vitas-M small molecule compound

2-(4-methylphenoxy)-N-{1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazol-5-yl}acetamide

Catalog ID
STK796361
SMILES O=C(Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccccc1)COc1ccc(cc1)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 C29H33N5O2 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O2/c1-22-8-11-25(12-9-22)36-21-29(35)30-23-10-13-27-26(20-23)31-28(32(27)2)14-15-33-16-18-34(19-17-33)24-6-4-3-5-7-24/h3-13,20H,14-19,21H2,1-2H3,(H,30,35)
InChIKey
YQCCIVUTVBIONI-UHFFFAOYSA-N
Synonyms
896811-40-8
2(4methylphenoxy)N(1methyl2(2(4phenylpiperazin1yl)ethyl)1Hbenzimidazol5yl)acetamide
2(4METHYLPHENOXY)N(1METHYL2(2(4PHENYLPIPERAZIN1YL)ETHYL)BENZIMIDAZOL5YL)ACETAMIDE
896811408
CC1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CCN4CCN(CC4)C5=CC=CC=C5)C
InChI=1SC29H33N5O2c12281125(12922)362129(35)302310132726(2023)3128(32(27)2)141533161834(191733)246435724h31320H141921H212H3(H3035)
MFCD06596116
N(1methyl2(2(4phenylpiperazin1yl)ethyl)1Hbenzo(d)imidazol5yl)2(ptolyloxy)acetamide
ZINC000057264358
ZINC57264358

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Available files

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