Vitas-M small molecule compound
1'-(4-fluorophenyl)-2,5'-dioxo-1-(prop-2-yn-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK782318
SMILES C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1ccc(cc1)F)C#N
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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 C30H21FN4O2 MW 488.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21FN4O2/c1-2-16-34-24-9-4-3-8-22(24)30(29(34)37)23(19-32)28(33-17-5-6-18-33)35(21-14-12-20(31)13-15-21)25-10-7-11-26(36)27(25)30/h1,3-6,8-9,12-15,17-18H,7,10-11,16H2InChIKey
JFYKVAXGPGSKLG-UHFFFAOYSA-NSynonyms
1(4fluorophenyl)25dioxo1(prop2yn1yl)2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1(4FLUOROPHENYL)25DIOXO1PROP2YNYL2PYRROL1YLSPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
C#CCN1C2=CC=CC=C2C3(C1=O)C(=C(N(C4=C3C(=O)CCC4)C5=CC=C(C=C5)F)N6C=CC=C6)C#N
InChI=1SC30H21FN4O2c12163424943822(24)30(29(34)37)23(1932)28(3317561833)35(21141220(31)131521)251071126(36)27(25)30h1368912151718H7101116H2
MFCD06017401
ZINC000012361914
ZINC000012361917
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