Vitas-M small molecule compound
2-amino-1-(5-bromopyridin-2-yl)-7,7-dimethyl-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK756388
SMILES N#CC1=C(N)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1ccc(cn1)Br
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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 C21H19BrN4OS MW 455.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4OS/c1-21(2)7-15-19(16(27)8-21)18(12-5-6-28-11-12)14(9-23)20(24)26(15)17-4-3-13(22)10-25-17/h3-6,10-11,18H,7-8,24H2,1-2H3InChIKey
UBRMJXBCUQQXPX-UHFFFAOYSA-NSynonyms
2amino1(5bromopyridin2yl)77dimethyl5oxo4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2AMINO1(5BROMOPYRIDIN2YL)77DIMETHYL5OXO4THIOPHEN3YL68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=NC=C(C=C3)Br)N)C#N)C4=CSC=C4)C(=O)C1)C
InChI=1SC21H19BrN4OSc121(2)71519(16(27)821)18(1256281112)14(923)20(24)26(15)174313(22)102517h36101118H7824H212H3
MFCD01239711
ZINC000000706066
ZINC000000706067
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