Vitas-M small molecule compound
2-amino-1-(4-bromophenyl)-4-(3,4-dimethoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754175
SMILES N#CC1=C(N)N(c2ccc(cc2)Br)C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CCC2
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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 C24H22BrN3O3 MW 480.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O3/c1-30-20-11-6-14(12-21(20)31-2)22-17(13-26)24(27)28(16-9-7-15(25)8-10-16)18-4-3-5-19(29)23(18)22/h6-12,22H,3-5,27H2,1-2H3InChIKey
HKBVQVRWSRAACQ-UHFFFAOYSA-NSynonyms
311334-30-22amino1(4bromophenyl)4(34dimethoxyphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(4bromophenyl)4(34dimethoxyphenyl)5oxo4678tetrahydroquinoline3carbonitrile
311334302
COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)Br)N)C#N)OC
InChI=1SC24H22BrN3O3c1302011614(1221(20)312)2217(1326)24(27)28(169715(25)81016)1843519(29)23(18)22h61222H3527H212H3
MFCD00825256
ZINC000001056577
ZINC000001056579
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