Vitas-M small molecule compound
2-amino-4-(4-ethoxyphenyl)-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755674
SMILES CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1ccc(cc1)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 C25H25N3O2 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O2/c1-3-30-19-13-9-17(10-14-19)23-20(15-26)25(27)28(18-11-7-16(2)8-12-18)21-5-4-6-22(29)24(21)23/h7-14,23H,3-6,27H2,1-2H3InChIKey
CNBLLVDSUQYHLM-UHFFFAOYSA-NSynonyms
2amino4(4ethoxyphenyl)1(4methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(4ethoxyphenyl)1(4methylphenyl)5oxo4678tetrahydroquinoline3carbonitrile
CCOC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)C)N)C#N
InChI=1SC25H25N3O2c13301913917(101419)2320(1526)25(27)28(1811716(2)81218)2154622(29)24(21)23h71423H3627H212H3
MFCD01113490
ZINC000000705645
ZINC000000705646
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