Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK031310
SMILES N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1CC(C)C)CCCC2
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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 C22H23BrN2OS MW 443.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2OS/c1-14(2)11-18-17-5-3-4-6-20(17)25-22(19(18)12-24)27-13-21(26)15-7-9-16(23)10-8-15/h7-10,14H,3-6,11,13H2,1-2H3InChIKey
IOOZBAXCVOLDKH-UHFFFAOYSA-NSynonyms
213203-93-12((2(4bromophenyl)2oxoethyl)sulfanyl)4(2methylpropyl)5678tetrahydroquinoline3carbonitrile
2((2(4bromophenyl)2oxoethyl)thio)4isobutyl5678tetrahydroquinoline3carbonitrile
2(2(4bromophenyl)2oxoethyl)sulfanyl4(2methylpropyl)5678tetrahydroquinoline3carbonitrile
213203931
CC(C)CC1=C(C(=NC2=C1CCCC2)SCC(=O)C3=CC=C(C=C3)Br)C#N
InChI=1SC22H23BrN2OSc114(2)111817534620(17)2522(19(18)1224)271321(26)157916(23)10815h71014H361113H212H3
MFCD00579909
N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1CC(C)C)CCCC2
STK031310
ZINC000003879152
ZINC03879152
ZINC3879152
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