Vitas-M small molecule compound
1-ethyl-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[4-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK687107
SMILES CCN1c2ccccc2C2(C1=O)C1=C(CCCC1=O)N(C(=C2C#N)n1cccc1)c1ccc(cc1)C(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 C30H23F3N4O2 MW 528.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23F3N4O2/c1-2-36-23-9-4-3-8-21(23)29(28(36)39)22(18-34)27(35-16-5-6-17-35)37(24-10-7-11-25(38)26(24)29)20-14-12-19(13-15-20)30(31,32)33/h3-6,8-9,12-17H,2,7,10-11H2,1H3InChIKey
XSWIKERRXUWKGH-UHFFFAOYSA-NSynonyms
1ethyl25dioxo2(1Hpyrrol1yl)1(4(trifluoromethyl)phenyl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1ETHYL25DIOXO2PYRROL1YL1(4(TRIFLUOROMETHYL)PHENYL)SPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
CCN1C2=CC=CC=C2C3(C1=O)C(=C(N(C4=C3C(=O)CCC4)C5=CC=C(C=C5)C(F)(F)F)N6C=CC=C6)C#N
InChI=1SC30H23F3N4O2c123623943821(23)29(28(36)39)22(1834)27(3516561735)37(241071125(38)26(24)29)20141219(131520)30(3132)33h36891217H271011H21H3
MFCD06617443
ZINC000098008187
ZINC000098008188
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