Vitas-M small molecule compound
2-amino-4-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755531
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)F)C(=O)CCC2)c1ccc(cc1)OC
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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 C23H20FN3O2 MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O2/c1-29-17-11-9-16(10-12-17)27-19-3-2-4-20(28)22(19)21(18(13-25)23(27)26)14-5-7-15(24)8-6-14/h5-12,21H,2-4,26H2,1H3InChIKey
QQFAEDULYSRIRR-UHFFFAOYSA-NSynonyms
2amino4(4fluorophenyl)1(4methoxyphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(4fluorophenyl)1(4methoxyphenyl)5oxo4678tetrahydroquinoline3carbonitrile
COC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(C=C4)F)C(=O)CCC3
InChI=1SC23H20FN3O2c1291711916(101217)271932420(28)22(19)21(18(1325)23(27)26)145715(24)8614h51221H2426H21H3
MFCD00828358
ZINC000001058096
ZINC000001058097
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