Vitas-M small molecule compound
2'-amino-5-fluoro-7',7'-dimethyl-2,5'-dioxo-1'-[2-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK776171
SMILES N#CC1=C(N)N(C2=C(C31C(=O)Nc1c3cc(F)cc1)C(=O)CC(C2)(C)C)c1ccccc1C(F)(F)F
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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 C26H20F4N4O2 MW 496.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20F4N4O2/c1-24(2)10-19-21(20(35)11-24)25(15-9-13(27)7-8-17(15)33-23(25)36)16(12-31)22(32)34(19)18-6-4-3-5-14(18)26(28,29)30/h3-9H,10-11,32H2,1-2H3,(H,33,36)InChIKey
QALQQHFAOAVHPK-UHFFFAOYSA-NSynonyms
2amino5fluoro77dimethyl25dioxo1(2(trifluoromethyl)phenyl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino5fluoro77dimethyl25dioxo1(2(trifluoromethyl)phenyl)spiro(1Hindole3468dihydroquinoline)3carbonitrile
CC1(CC2=C(C(=O)C1)C3(C4=C(C=CC(=C4)F)NC3=O)C(=C(N2C5=CC=CC=C5C(F)(F)F)N)C#N)C
InChI=1SC26H20F4N4O2c124(2)101921(20(35)1124)25(15913(27)7817(15)3323(25)36)16(1231)22(32)34(19)18643514(18)26(2829)30h39H101132H212H3(H3336)
MFCD05258634
ZINC000012402232
ZINC000012402233
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