Vitas-M small molecule compound

2-[(2-methoxybenzyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

Catalog ID
STK546336
SMILES N#Cc1cc2CCCCCc2nc1SCc1ccccc1OC

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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 C19H20N2OS MW 324.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2OS/c1-22-18-10-6-5-8-15(18)13-23-19-16(12-20)11-14-7-3-2-4-9-17(14)21-19/h5-6,8,10-11H,2-4,7,9,13H2,1H3
InChIKey
YZGIUAYYTRZPOO-UHFFFAOYSA-N
Synonyms
445384-18-9
2((2methoxybenzyl)sulfanyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2((2methoxybenzyl)thio)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2((2methoxyphenyl)methylsulfanyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
445384189
COC1=CC=CC=C1CSC2=NC3=C(CCCCC3)C=C2C#N
InChI=1SC19H20N2OSc122181065815(18)13231916(1220)11147324917(14)2119h5681011H247913H21H3
MFCD03234639
ZINC000000377351
ZINC00377351
ZINC377351

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Available files

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