Vitas-M small molecule compound
1'-(3-chloro-2-methylphenyl)-1-methyl-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
STK783057
SMILES N#CC1=C(n2cccc2)N(c2cccc(c2C)Cl)C2=C(C31C(=O)N(c1c3cccc1)C)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 C29H23ClN4O2 MW 494.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClN4O2/c1-18-21(30)10-7-12-22(18)34-24-13-8-14-25(35)26(24)29(20(17-31)27(34)33-15-5-6-16-33)19-9-3-4-11-23(19)32(2)28(29)36/h3-7,9-12,15-16H,8,13-14H2,1-2H3InChIKey
AJHBPQNFUBQIGE-UHFFFAOYSA-NSynonyms
1(3chloro2methylphenyl)1methyl25dioxo2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1(3CHLORO2METHYLPHENYL)1METHYL25DIOXO2PYRROL1YLSPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
CC1=C(C=CC=C1Cl)N2C3=C(C(=O)CCC3)C4(C5=CC=CC=C5N(C4=O)C)C(=C2N6C=CC=C6)C#N
InChI=1SC29H23ClN4O2c11821(30)1071222(18)34241381425(35)26(24)29(20(1731)27(34)3315561633)199341123(19)32(2)28(29)36h379121516H81314H212H3
MFCD06617448
ZINC000012372453
ZINC000012372454
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