Vitas-M small molecule compound
2-amino-4-(4-bromophenyl)-1-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754373
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)Br)C(=O)CC(C2)(C)C)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 C25H24BrN3O2 MW 478.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O2/c1-25(2)12-20-23(21(30)13-25)22(15-4-6-16(26)7-5-15)19(14-27)24(28)29(20)17-8-10-18(31-3)11-9-17/h4-11,22H,12-13,28H2,1-3H3InChIKey
LKMOHLRRHHZFOZ-UHFFFAOYSA-NSynonyms
2amino4(4bromophenyl)1(4methoxyphenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(4BROMOPHENYL)1(4METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)OC)N)C#N)C4=CC=C(C=C4)Br)C(=O)C1)C
InChI=1SC25H24BrN3O2c125(2)122023(21(30)1325)22(154616(26)7515)19(1427)24(28)29(20)1781018(313)11917h41122H121328H213H3
MFCD00825630
ZINC000000705489
ZINC000000705490
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