Vitas-M small molecule compound

3-[(3-ethyl-2,8-dimethylquinolin-4-yl)sulfanyl]propanenitrile

Catalog ID
STL302682
SMILES N#CCCSc1c(CC)c(C)nc2c1cccc2C

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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 C16H18N2S MW 270.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2S/c1-4-13-12(3)18-15-11(2)7-5-8-14(15)16(13)19-10-6-9-17/h5,7-8H,4,6,10H2,1-3H3
InChIKey
BLCJFMITZKDTAW-UHFFFAOYSA-N
Synonyms
488708-18-5
3((3ethyl28dimethylquinolin4yl)sulfanyl)propanenitrile
3((3ethyl28dimethylquinolin4yl)thio)propanenitrile
3(3ETHYL28DIMETHYLQUINOLIN4YL)SULFANYLPROPANENITRILE
3(3ETHYL28DIMETHYLQUINOLIN4YLSULFANYL)PROPIONITRILE
488708185
CCC1=C(C2=C(C(=CC=C2)C)N=C1C)SCCC#N
InChI=1SC16H18N2Sc141312(3)181511(2)75814(15)16(13)19106917h578H4610H213H3
MFCD03290683
ZINC000002335776
ZINC02335776
ZINC2335776

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Available files

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