Vitas-M small molecule compound
2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-[4-(prop-2-en-1-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK774046
SMILES C=CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)N(C)C)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 C27H28N4O2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2/c1-4-14-33-21-12-10-19(11-13-21)25-22(17-28)27(29)31(30(2)3)23-15-20(16-24(32)26(23)25)18-8-6-5-7-9-18/h4-13,20,25H,1,14-16,29H2,2-3H3InChIKey
NBLVHRKIUNWRCI-UHFFFAOYSA-NSynonyms
2amino1(dimethylamino)5oxo7phenyl4(4(prop2en1yloxy)phenyl)145678hexahydroquinoline3carbonitrile
2amino1(dimethylamino)5oxo7phenyl4(4prop2enoxyphenyl)4678tetrahydroquinoline3carbonitrile
CN(C)N1C2=C(C(C(=C1N)C#N)C3=CC=C(C=C3)OCC=C)C(=O)CC(C2)C4=CC=CC=C4
InChI=1SC27H28N4O2c14143321121019(111321)2522(1728)27(29)31(30(2)3)231520(1624(32)26(23)25)188657918h4132025H1141629H223H3
MFCD03856010
ZINC000003627736
ZINC000003627746
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