Vitas-M small molecule compound

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

Catalog ID
STK525283
SMILES N#Cc1c(Cl)nc(c2c1CC(C)(C)SC2)c1ccccc1

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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 C17H15ClN2S MW 314.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2S/c1-17(2)8-12-13(9-19)16(18)20-15(14(12)10-21-17)11-6-4-3-5-7-11/h3-7H,8,10H2,1-2H3
InChIKey
BCKXMUWUKOIWIY-UHFFFAOYSA-N
Synonyms
138292-24-7
138292247
1HTHIOPYRANO(34C)PYRIDINE5CARBONITRILE6CHLORO33DIMETHYL8PHENYL
6CHLORO33DIMETHYL8PHENYL14DIHYDROTHIOPYRANO(34C)PYRIDINE5CARBONITRILE
6chloro33dimethyl8phenyl34dihydro1Hthiopyrano(34c)pyridine5carbonitrile
CC1(CC2=C(C(=NC(=C2CS1)C3=CC=CC=C3)Cl)C#N)C
InChI=1SC17H15ClN2Sc117(2)81213(919)16(18)2015(14(12)102117)116435711h37H810H212H3
ZINC000004785106
ZINC04785106
ZINC4785106

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Available files

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