Vitas-M small molecule compound

1-octadecyl-1H-benzimidazole-2-thiol

Catalog ID
STK738178
SMILES CCCCCCCCCCCCCCCCCCn1c(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 C25H42N2S MW 402.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H42N2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-27-24-21-18-17-20-23(24)26-25(27)28/h17-18,20-21H,2-16,19,22H2,1H3,(H,26,28)
InChIKey
KHDDHGCKJHOEKC-UHFFFAOYSA-N
Synonyms
537009-89-5
1OCTADECYL13DIHYDRO2HBENZIMIDAZOLE2THIONE
1octadecyl1Hbenzimidazole2thiol
1octadecyl1Hbenzo(d)imidazole2thiol
1OCTADECYLBENZIMIDAZOLE2THIOL
3OCTADECYL1HBENZIMIDAZOLE2THIONE
537009895
CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2NC1=S
InChI=1SC25H42N2Sc12345678910111213141516192227242118172023(24)2625(27)28h17182021H2161922H21H3(H2628)
MFCD03668790
ZINC000097951848
ZINC97951848

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Available files

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