Vitas-M small molecule compound

4,5,6-trimethyl-2-(propylsulfanyl)pyridine-3-carbonitrile

Catalog ID
STL112906
SMILES CCCSc1nc(C)c(c(c1C#N)C)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 C12H16N2S MW 220.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2S/c1-5-6-15-12-11(7-13)9(3)8(2)10(4)14-12/h5-6H2,1-4H3
InChIKey
SPIBQRQTSNWQFC-UHFFFAOYSA-N
Synonyms

456trimethyl2(propylsulfanyl)pyridine3carbonitrile
456TRIMETHYL2PROPYLSULFANYLPYRIDINE3CARBONITRILE
CCCSC1=NC(=C(C(=C1C#N)C)C)C
InChI=1SC12H16N2Sc156151211(713)9(3)8(2)10(4)1412h56H214H3
MFCD00569863
ZINC000003186181
ZINC03186181
ZINC3186181

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Available files

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