Vitas-M small molecule compound
2-[(4-chlorobenzyl)sulfanyl]-5-oxo-4-[4-(propan-2-yl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK826207
SMILES N#CC1=C(SCc2ccc(cc2)Cl)NC2=C(C1c1ccc(cc1)C(C)C)C(=O)CCC2
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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 C26H25ClN2OS MW 449.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2OS/c1-16(2)18-8-10-19(11-9-18)24-21(14-28)26(29-22-4-3-5-23(30)25(22)24)31-15-17-6-12-20(27)13-7-17/h6-13,16,24,29H,3-5,15H2,1-2H3InChIKey
YUSSLFCKMMLGGW-UHFFFAOYSA-NSynonyms
500276-50-62((4chlorobenzyl)sulfanyl)5oxo4(4(propan2yl)phenyl)145678hexahydroquinoline3carbonitrile
2((4chlorobenzyl)thio)4(4isopropylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2((4chlorophenyl)methylsulfanyl)5oxo4(4propan2ylphenyl)4678tetrahydro1Hquinoline3carbonitrile
500276506
CC(C)C1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC4=CC=C(C=C4)Cl)C#N
InChI=1SC26H25ClN2OSc116(2)1881019(11918)2421(1428)26(292243523(30)25(22)24)31151761220(27)13717h613162429H3515H212H3
MFCD03303277
ZINC000002354636
ZINC000002354639
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