Vitas-M small molecule compound
2-amino-4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755183
SMILES N#CC1=C(N)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1C)Cl
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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 C24H20ClN3O3 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O3/c1-13-16(25)4-2-5-17(13)28-18-6-3-7-19(29)23(18)22(15(11-26)24(28)27)14-8-9-20-21(10-14)31-12-30-20/h2,4-5,8-10,22H,3,6-7,12,27H2,1H3InChIKey
SBKBIMAHZHNSOX-UHFFFAOYSA-NSynonyms
311328-60-62amino4(13benzodioxol5yl)1(3chloro2methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(13benzodioxol5yl)1(3chloro2methylphenyl)5oxo4678tetrahydroquinoline3carbonitrile
311328606
CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N)C#N)C4=CC5=C(C=C4)OCO5)C(=O)CCC3
InChI=1SC24H20ClN3O3c11316(25)42517(13)281863719(29)23(18)22(15(1126)24(28)27)14892021(1014)31123020h24581022H3671227H21H3
MFCD00827446
ZINC000001445441
ZINC000001445442
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