Vitas-M small molecule compound

1-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole-2-thiol

Catalog ID
STK364974
SMILES Cc1cccc(c1)OCCn1c(S)nc2c1cccc2

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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 C16H16N2OS MW 284.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2OS/c1-12-5-4-6-13(11-12)19-10-9-18-15-8-3-2-7-14(15)17-16(18)20/h2-8,11H,9-10H2,1H3,(H,17,20)
InChIKey
SXLRVSIKAKXSGF-UHFFFAOYSA-N
Synonyms
303133-12-2
1(2(3METHYLPHENOXY)ETHYL)1HBENZIMIDAZOL2YLHYDROSULFIDE
1(2(3METHYLPHENOXY)ETHYL)1HBENZIMIDAZOLE2THIOL
1(2(3METHYLPHENOXY)ETHYL)BENZIMIDAZOLE2THIOL
1(2MTOLYLOXYETHYL)1HBENZOIMIDAZOLE2THIOL
3(2(3METHYLPHENOXY)ETHYL)1HBENZIMIDAZOLE2THIONE
303133122
CC1=CC(=CC=C1)OCCN2C3=CC=CC=C3NC2=S
InChI=1SC16H16N2OSc11254613(1112)191091815832714(15)1716(18)20h2811H910H21H3(H1720)
MFCD01128206
ZINC000006533938
ZINC06533938
ZINC6533938

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Available files

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