Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK014202
SMILES CC(CC1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC2=C1C(=O)CCC2)C#N)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 C22H24BrN3O2S MW 474.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN3O2S/c1-13(2)10-16-17(11-24)22(26-18-4-3-5-19(27)21(16)18)29-12-20(28)25-15-8-6-14(23)7-9-15/h6-9,13,16,26H,3-5,10,12H2,1-2H3,(H,25,28)InChIKey
UQZOABGTSQGNHN-UHFFFAOYSA-NSynonyms
252351-67-0252351670
CC(C)CC1C(=C(NC2=C1C(=O)CCC2)SCC(=O)NC3=CC=C(C=C3)Br)C#N
CC(CC1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC2=C1C(=O)CCC2)C#N)C
InChI=1SC22H24BrN3O2Sc113(2)101617(1124)22(261843519(27)21(16)18)291220(28)25158614(23)7915h69131626H351012H212H3(H2528)
MFCD01464804
N(4bromophenyl)2((3cyano4(2methylpropyl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
N(4bromophenyl)2((3cyano4(2methylpropyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
N(4bromophenyl)2((3cyano4isobutyl5oxo145678hexahydroquinolin2yl)thio)acetamide
STK014202
ZINC000001000328
ZINC000019901097
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