Vitas-M small molecule compound

2-{[(2-phenylethyl)sulfanyl]methyl}-1H-benzimidazole

Catalog ID
STL482006
SMILES c1ccc(cc1)CCSCc1nc2c([nH]1)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/c1-2-6-13(7-3-1)10-11-19-12-16-17-14-8-4-5-9-15(14)18-16/h1-9H,10-12H2,(H,17,18)
InChIKey
GJIKDRDDVADEPW-UHFFFAOYSA-N
Synonyms

1HBENZIMIDAZOL2YLMETHYL2PHENYLETHYLSULFIDE
2(((2phenylethyl)sulfanyl)methyl)1Hbenzimidazole
2(2phenylethylsulfanylmethyl)1Hbenzimidazole
2(PHENETHYLSULFANYLMETHYL)1HBENZIMIDAZOLE
BENZIMIDAZOL2YL(2PHENYLETHYLTHIO)METHANE
C1=CC=C(C=C1)CCSCC2=NC3=CC=CC=C3N2
c1ccc(cc1)CCSCc1nc2c((nH)1)cccc2
InChI=1SC16H16N2Sc12613(731)10111912161714845915(14)1816h19H1012H2(H1718)
MFCD05987054
ZINC000002845452
ZINC02845452
ZINC2845452

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Available files

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