Vitas-M small molecule compound
2-amino-4-(4-bromophenyl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754171
SMILES N#CC1=C(N)N(c2cccc(c2)C)C2=C(C1c1ccc(cc1)Br)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 C25H24BrN3O MW 462.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O/c1-15-5-4-6-18(11-15)29-20-12-25(2,3)13-21(30)23(20)22(19(14-27)24(29)28)16-7-9-17(26)10-8-16/h4-11,22H,12-13,28H2,1-3H3InChIKey
QBKASLNLFLEENG-UHFFFAOYSA-NSynonyms
2amino4(4bromophenyl)77dimethyl1(3methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(4BROMOPHENYL)77DIMETHYL1(3METHYLPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=CC(=CC=C1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(C=C4)Br)C(=O)CC(C3)(C)C
InChI=1SC25H24BrN3Oc11554618(1115)29201225(23)1321(30)23(20)22(19(1427)24(29)28)167917(26)10816h41122H121328H213H3
MFCD00825252
ZINC000001022598
ZINC000001022599
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