Vitas-M small molecule compound
4-amino-7'-bromo-5'-fluoro-2'-oxo-1',2',6,7-tetrahydrospiro[1,3-dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Catalog ID
STK573075
SMILES N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(F)cc1Br)cc1c(c3)OCO1
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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 C22H14BrFN4O3 MW 481.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrFN4O3/c23-15-5-11(24)4-13-19(15)27-21(29)22(13)7-16-12-6-18-17(30-9-31-18)3-10(12)1-2-28(16)20(26)14(22)8-25/h3-7H,1-2,9,26H2,(H,27,29)InChIKey
HFJBBWPTDYDUTG-UHFFFAOYSA-NSynonyms
883951-19-74amino7bromo5fluoro2oxo1267tetrahydrospiro(13dioxolo(45g)pyrido(21a)isoquinoline23indole)3carbonitrile
4amino7bromo5fluoro2oxo67dihydrospiro((13)dioxolo(45g)pyrido(21a)isoquinoline23indoline)3carbonitrile
4amino7bromo5fluoro2oxospiro(1Hindole3267dihydro(13)benzodioxolo(65a)quinolizine)3carbonitrile
883951197
C1CN2C(=CC3(C4=CC(=CC(=C4NC3=O)Br)F)C(=C2N)C#N)C5=CC6=C(C=C51)OCO6
InChI=1SC22H14BrFN4O3c2315511(24)41319(15)2721(29)22(13)7161261817(3093118)310(12)1228(16)20(26)14(22)825h37H12926H2(H2729)
MFCD07639310
ZINC000013591131
ZINC000013591133
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