Vitas-M small molecule compound

2-[(2,5-dimethylbenzyl)sulfanyl]-1H-benzimidazole

Catalog ID
STK866274
SMILES Cc1ccc(c(c1)CSc1nc2c([nH]1)cccc2)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 C16H16N2S MW 268.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2S/c1-11-7-8-12(2)13(9-11)10-19-16-17-14-5-3-4-6-15(14)18-16/h3-9H,10H2,1-2H3,(H,17,18)
InChIKey
IXFISWKOKSTFCO-UHFFFAOYSA-N
Synonyms
615280-11-0
2((25dimethylbenzyl)sulfanyl)1Hbenzimidazole
2((25DIMETHYLBENZYL)THIO)1HBENZO(D)IMIDAZOLE
2((25DIMETHYLPHENYL)METHYLSULFANYL)1HBENZIMIDAZOLE
2((25DIMETHYLPHENYL)METHYLTHIO)BENZIMIDAZOLE
615280110
CC1=CC(=C(C=C1)C)CSC2=NC3=CC=CC=C3N2
Cc1ccc(c(c1)CSc1nc2c((nH)1)cccc2)C
InChI=1SC16H16N2Sc1117812(2)13(911)1019161714534615(14)1816h39H10H212H3(H1718)
MFCD03551797
ZINC000000477330
ZINC00477330
ZINC477330

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Available files

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