Vitas-M small molecule compound

1-(4-methylbenzyl)-2-(methylsulfanyl)-1H-benzimidazole

Catalog ID
STK791051
SMILES CSc1nc2c(n1Cc1ccc(cc1)C)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 C16H16N2S MW 268.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2S/c1-12-7-9-13(10-8-12)11-18-15-6-4-3-5-14(15)17-16(18)19-2/h3-10H,11H2,1-2H3
InChIKey
VKWJXVPDCLRBKG-UHFFFAOYSA-N
Synonyms
708998-52-1
1((4METHYLPHENYL)METHYL)2METHYLSULFANYLBENZIMIDAZOLE
1((4METHYLPHENYL)METHYL)2METHYLTHIOBENZIMIDAZOLE
1(4methylbenzyl)2(methylsulfanyl)1Hbenzimidazole
1(4METHYLBENZYL)2(METHYLTHIO)1HBENZO(D)IMIDAZOLE
1H13BENZIMIDAZOLE1((4METHYLPHENYL)METHYL)2(METHYLTHIO)
708998521
CC1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SC
InChI=1SC16H16N2Sc1127913(10812)111815643514(15)1716(18)192h310H11H212H3
MFCD05993583
ZINC000000561381
ZINC00561381
ZINC561381

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Available files

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