Vitas-M small molecule compound
N-(5-bromopyridin-2-yl)-4-(1,3-dimethyl-1H-pyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL400662
SMILES Brc1ccc(nc1)NC(=O)C1=C(C)NC2=C(C1c1cn(nc1C)C)C(=O)CC(C2)(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 C23H26BrN5O2 MW 484.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrN5O2/c1-12-15(11-29(5)28-12)20-19(22(31)27-18-7-6-14(24)10-25-18)13(2)26-16-8-23(3,4)9-17(30)21(16)20/h6-7,10-11,20,26H,8-9H2,1-5H3,(H,25,27,31)InChIKey
FLQIEXNWQMHHOG-UHFFFAOYSA-NSynonyms
515149-69-6515149696
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN(N=C3C)C)C(=O)NC4=NC=C(C=C4)Br
InChI=1SC23H26BrN5O2c11215(1129(5)2812)2019(22(31)27187614(24)102518)13(2)2616823(34)917(30)21(16)20h6710112026H89H215H3(H252731)
MFCD03758304
N(5bromopyridin2yl)4(13dimethyl1Hpyrazol4yl)277trimethyl5oxo145678hexahydroquinoline3carboxamide
N(5bromopyridin2yl)4(13dimethylpyrazol4yl)277trimethyl5oxo1468tetrahydroquinoline3carboxamide
ZINC000008440410
ZINC000008440415
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