Vitas-M small molecule compound

2-{[3-(2-methylphenoxy)propyl]sulfanyl}-1H-benzimidazole

Catalog ID
STK895202
SMILES Cc1ccccc1OCCCSc1nc2c([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 C17H18N2OS MW 298.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2OS/c1-13-7-2-5-10-16(13)20-11-6-12-21-17-18-14-8-3-4-9-15(14)19-17/h2-5,7-10H,6,11-12H2,1H3,(H,18,19)
InChIKey
QTFIJMSMSXCMSF-UHFFFAOYSA-N
Synonyms
615280-09-6
1(3BENZIMIDAZOL2YLTHIOPROPOXY)2METHYLBENZENE
2((3(2methylphenoxy)propyl)sulfanyl)1Hbenzimidazole
2((3(2METHYLPHENOXY)PROPYL)THIO)1HBENZIMIDAZOLE
2((3(OTOLYLOXY)PROPYL)THIO)1HBENZO(D)IMIDAZOLE
2(3(2METHYLPHENOXY)PROPYLSULFANYL)1HBENZIMIDAZOLE
615280096
CC1=CC=CC=C1OCCCSC2=NC3=CC=CC=C3N2
Cc1ccccc1OCCCSc1nc2c((nH)1)cccc2
InChI=1SC17H18N2OSc1137251016(13)201161221171814834915(14)1917h25710H61112H21H3(H1819)
MFCD04212660
ZINC000001926970
ZINC01926970
ZINC1926970

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Available files

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