Vitas-M small molecule compound
2-amino-1-(3-bromophenyl)-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK760531
SMILES N#CC1=C(N)N(c2cccc(c2)Br)C2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C
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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 C24H21BrFN3O MW 466.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrFN3O/c1-24(2)11-19-22(20(30)12-24)21(14-6-8-16(26)9-7-14)18(13-27)23(28)29(19)17-5-3-4-15(25)10-17/h3-10,21H,11-12,28H2,1-2H3InChIKey
YOGGKZYNEVSFEB-UHFFFAOYSA-NSynonyms
2amino1(3bromophenyl)4(4fluorophenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(3BROMOPHENYL)4(4FLUOROPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)Br)N)C#N)C4=CC=C(C=C4)F)C(=O)C1)C
InChI=1SC24H21BrFN3Oc124(2)111922(20(30)1224)21(146816(26)9714)18(1327)23(28)29(19)1753415(25)1017h31021H111228H212H3
MFCD01821867
ZINC000001064077
ZINC000001064079
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