Vitas-M small molecule compound
2-(ethylsulfanyl)-5-oxo-4-[4-(propan-2-yl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK826187
SMILES CCSC1=C(C#N)C(C2=C(N1)CCCC2=O)c1ccc(cc1)C(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 C21H24N2OS MW 352.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS/c1-4-25-21-16(12-22)19(15-10-8-14(9-11-15)13(2)3)20-17(23-21)6-5-7-18(20)24/h8-11,13,19,23H,4-7H2,1-3H3InChIKey
DPVFFIJJKJDOHU-UHFFFAOYSA-NSynonyms
488796-31-22(ethylsulfanyl)5oxo4(4(propan2yl)phenyl)145678hexahydroquinoline3carbonitrile
2(ethylthio)4(4isopropylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2ethylsulfanyl5oxo4(4propan2ylphenyl)4678tetrahydro1Hquinoline3carbonitrile
488796312
CCSC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(C)C)C#N
InChI=1SC21H24N2OSc14252116(1222)19(1510814(91115)13(2)3)2017(2321)65718(20)24h811131923H47H213H3
MFCD03292854
ZINC000002342471
ZINC000006138609
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