Vitas-M small molecule compound
2-amino-4-(4-bromothiophen-2-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754807
SMILES N#CC1=C(N)N(c2cccc(c2)C)C2=C(C1c1scc(c1)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 C23H22BrN3OS MW 468.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3OS/c1-13-5-4-6-15(7-13)27-17-9-23(2,3)10-18(28)21(17)20(16(11-25)22(27)26)19-8-14(24)12-29-19/h4-8,12,20H,9-10,26H2,1-3H3InChIKey
STQDPUJAXSKFMO-UHFFFAOYSA-NSynonyms
2amino4(4bromothiophen2yl)77dimethyl1(3methylphenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(4BROMOTHIOPHEN2YL)77DIMETHYL1(3METHYLPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=CC(=CC=C1)N2C3=C(C(C(=C2N)C#N)C4=CC(=CS4)Br)C(=O)CC(C3)(C)C
InChI=1SC23H22BrN3OSc11354615(713)2717923(23)1018(28)21(17)20(16(1125)22(27)26)19814(24)122919h481220H91026H213H3
MFCD00826667
ZINC000000705445
ZINC000000705446
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