Vitas-M small molecule compound
1'-(3-fluorophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK783033
SMILES N#CC1=C(n2cccc2)N(c2cccc(c2)F)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2
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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 C27H19FN4O2 MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN4O2/c28-17-7-5-8-18(15-17)32-22-11-6-12-23(33)24(22)27(19-9-1-2-10-21(19)30-26(27)34)20(16-29)25(32)31-13-3-4-14-31/h1-5,7-10,13-15H,6,11-12H2,(H,30,34)InChIKey
WIKPZQLXNDZFGO-UHFFFAOYSA-NSynonyms
1(3fluorophenyl)25dioxo2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1(3fluorophenyl)25dioxo2pyrrol1ylspiro(1Hindole3478dihydro6Hquinoline)3carbonitrile
C1CC2=C(C(=O)C1)C3(C4=CC=CC=C4NC3=O)C(=C(N2C5=CC(=CC=C5)F)N6C=CC=C6)C#N
InChI=1SC27H19FN4O2c281775818(1517)32221161223(33)24(22)27(199121021(19)3026(27)34)20(1629)25(32)3113341431h157101315H61112H2(H3034)
MFCD06617410
ZINC000012377297
ZINC000012377298
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