Vitas-M small molecule compound

3-(methylsulfanyl)-1-(morpholin-4-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridine-4-carbonitrile

Catalog ID
STK836070
SMILES N#Cc1c(SC)nc(c2c1CCCCC2)N1CCOCC1

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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 C16H21N3OS MW 303.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3OS/c1-21-16-14(11-17)12-5-3-2-4-6-13(12)15(18-16)19-7-9-20-10-8-19/h2-10H2,1H3
InChIKey
GNNCRDKWDNGWLE-UHFFFAOYSA-N
Synonyms

3(methylsulfanyl)1(morpholin4yl)6789tetrahydro5Hcyclohepta(c)pyridine4carbonitrile
3(methylthio)1morpholino6789tetrahydro5Hcyclohepta(c)pyridine4carbonitrile
3methylsulfanyl1morpholin4yl6789tetrahydro5Hcyclohepta(c)pyridine4carbonitrile
CSC1=NC(=C2CCCCCC2=C1C#N)N3CCOCC3
InChI=1SC16H21N3OSc1211614(1117)125324613(12)15(1816)19792010819h210H21H3
MFCD02241260
ZINC000019946850
ZINC19946850

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Available files

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