Vitas-M small molecule compound

5-methyl-2-{[4-(3-methylphenoxy)butyl]sulfanyl}-1H-benzimidazole

Catalog ID
STK732855
SMILES Cc1cccc(c1)OCCCCSc1[nH]c2c(n1)cc(cc2)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 C19H22N2OS MW 326.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2OS/c1-14-6-5-7-16(12-14)22-10-3-4-11-23-19-20-17-9-8-15(2)13-18(17)21-19/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,20,21)
InChIKey
JEMZTENYXGKZJW-UHFFFAOYSA-N
Synonyms

5methyl2((4(3methylphenoxy)butyl)sulfanyl)1Hbenzimidazole
6METHYL2(4(3METHYLPHENOXY)BUTYLSULFANYL)1HBENZIMIDAZOLE
CC1=CC(=CC=C1)OCCCCSC2=NC3=C(N2)C=C(C=C3)C
Cc1cccc(c1)OCCCCSc1(nH)c2c(n1)cc(cc2)C
InChI=1SC19H22N2OSc11465716(1214)22103411231920179815(2)1318(17)2119h591213H341011H212H3(H2021)
MFCD04340713
ZINC000002666052
ZINC02666052
ZINC2666052

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Available files

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