Vitas-M small molecule compound

2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-1-(2-methylpiperidin-1-yl)ethanone

Catalog ID
STL450801
SMILES Cc1cccc(c1)OCCSc1nc2c(n1CC(=O)N1CCCCC1C)cccc2

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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 C24H29N3O2S MW 423.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2S/c1-18-8-7-10-20(16-18)29-14-15-30-24-25-21-11-3-4-12-22(21)27(24)17-23(28)26-13-6-5-9-19(26)2/h3-4,7-8,10-12,16,19H,5-6,9,13-15,17H2,1-2H3
InChIKey
HJRBJYBIOLTWKJ-UHFFFAOYSA-N
Synonyms

2(2((2(3methylphenoxy)ethyl)sulfanyl)1Hbenzimidazol1yl)1(2methylpiperidin1yl)ethanone
2(2(2(3methylphenoxy)ethylsulfanyl)benzimidazol1yl)1(2methylpiperidin1yl)ethanone
2(2(2(3METHYLPHENOXY)ETHYLTHIO)BENZIMIDAZOLYL)1(2METHYLPIPERIDYL)ETHAN1ONE
CC1CCCCN1C(=O)CN2C3=CC=CC=C3N=C2SCCOC4=CC=CC(=C4)C
InChI=1SC24H29N3O2Sc118871020(1618)2914153024252111341222(21)27(24)1723(28)261365919(26)2h347810121619H569131517H212H3
MFCD10044625
ZINC000012062365
ZINC000012062366

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Available files

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