Vitas-M small molecule compound
2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-cyanophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL174867
SMILES N#CC1=C(N)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)c1ccccc1)c1ccccc1C#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 C30H22N4O3 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22N4O3/c31-15-20-8-4-5-9-23(20)34-24-12-21(18-6-2-1-3-7-18)13-25(35)29(24)28(22(16-32)30(34)33)19-10-11-26-27(14-19)37-17-36-26/h1-11,14,21,28H,12-13,17,33H2InChIKey
SCCDJMIVYOCERI-UHFFFAOYSA-NSynonyms
444933-56-62amino4(13benzodioxol5yl)1(2cyanophenyl)5oxo7phenyl145678hexahydroquinoline3carbonitrile
2amino4(13benzodioxol5yl)1(2cyanophenyl)5oxo7phenyl4678tetrahydroquinoline3carbonitrile
444933566
C1C(CC(=O)C2=C1N(C(=C(C2C3=CC4=C(C=C3)OCO4)C#N)N)C5=CC=CC=C5C#N)C6=CC=CC=C6
InChI=1SC30H22N4O3c311520845923(20)34241221(186213718)1325(35)29(24)28(22(1632)30(34)33)1910112627(1419)37173626h111142128H12131733H2
MFCD03071231
ZINC000000673418
ZINC000000673424
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