Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK543660
SMILES N#CC1=C(SCc2ccccc2Cl)NC2=C(C1c1ccc(cc1)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 C24H21ClN2OS MW 420.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2OS/c1-15-9-11-16(12-10-15)22-18(13-26)24(27-20-7-4-8-21(28)23(20)22)29-14-17-5-2-3-6-19(17)25/h2-3,5-6,9-12,22,27H,4,7-8,14H2,1H3InChIKey
DHNCHKQNSQEQBQ-UHFFFAOYSA-NSynonyms
497244-77-62((2chlorobenzyl)sulfanyl)4(4methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2((2chlorobenzyl)thio)5oxo4(ptolyl)145678hexahydroquinoline3carbonitrile
2((2chlorophenyl)methylsulfanyl)4(4methylphenyl)5oxo4678tetrahydro1Hquinoline3carbonitrile
497244776
CC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC4=CC=CC=C4Cl)C#N
InChI=1SC24H21ClN2OSc11591116(121015)2218(1326)24(272074821(28)23(20)22)291417523619(17)25h23569122227H47814H21H3
MFCD03300371
ZINC000002341531
ZINC000002341533
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