Vitas-M small molecule compound

8-butyl-6-chloro-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile

Catalog ID
STK524561
SMILES CCCCc1nc(Cl)c(c2c1CSC(C2)(C)C)C#N

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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 C15H19ClN2S MW 294.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19ClN2S/c1-4-5-6-13-12-9-19-15(2,3)7-10(12)11(8-17)14(16)18-13/h4-7,9H2,1-3H3
InChIKey
QYLFWFGCNSINJU-UHFFFAOYSA-N
Synonyms
371960-03-1
1HTHIOPYRANO(34C)PYRIDINE5CARBONITRILE8BUTYL6CHLORO33DIMETHYL34DIHYDRO
371960031
8BUTYL6CHLORO33DIMETHYL14DIHYDROTHIOPYRANO(34C)PYRIDINE5CARBONITRILE
8butyl6chloro33dimethyl34dihydro1Hthiopyrano(34c)pyridine5carbonitrile
CCCCC1=C2CSC(CC2=C(C(=N1)Cl)C#N)(C)C
InChI=1SC15H19ClN2Sc1456131291915(23)710(12)11(817)14(16)1813h479H213H3
MFCD01875753
ZINC000004836974
ZINC04836974
ZINC4836974

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Available files

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