Vitas-M small molecule compound
2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754178
SMILES N#CC1=C(N)N(C2=C(C1c1ccccc1)C(=O)CC(C2)(C)C)c1ccc(cc1)Br
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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 C24H22BrN3O MW 448.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O/c1-24(2)12-19-22(20(29)13-24)21(15-6-4-3-5-7-15)18(14-26)23(27)28(19)17-10-8-16(25)9-11-17/h3-11,21H,12-13,27H2,1-2H3InChIKey
MDZSXDZQFPSYKV-UHFFFAOYSA-NSynonyms
311334-32-42amino1(4bromophenyl)77dimethyl5oxo4phenyl145678hexahydroquinoline3carbonitrile
2AMINO1(4BROMOPHENYL)77DIMETHYL5OXO4PHENYL68DIHYDRO4HQUINOLINE3CARBONITRILE
311334324
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Br)N)C#N)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC24H22BrN3Oc124(2)121922(20(29)1324)21(156435715)18(1426)23(27)28(19)1710816(25)91117h31121H121327H212H3
MFCD00825259
ZINC000000705491
ZINC000000705492
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