Vitas-M small molecule compound
methyl 2-amino-4-(4-bromophenyl)-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK673877
SMILES COC(=O)C1=C(N)N(C2=C(C1c1ccc(cc1)Br)C(=O)CC(C2)(C)C)c1cccc(c1C)Cl
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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 C26H26BrClN2O3 MW 529.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrClN2O3/c1-14-17(28)6-5-7-18(14)30-19-12-26(2,3)13-20(31)22(19)21(15-8-10-16(27)11-9-15)23(24(30)29)25(32)33-4/h5-11,21H,12-13,29H2,1-4H3InChIKey
SULFWCIDGXYCCG-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N)C(=O)OC)C4=CC=C(C=C4)Br)C(=O)CC(C3)(C)C
InChI=1SC26H26BrClN2O3c11417(28)65718(14)30191226(23)1320(31)22(19)21(1581016(27)11915)23(24(30)29)25(32)334h51121H121329H214H3
methyl2amino4(4bromophenyl)1(3chloro2methylphenyl)77dimethyl5oxo145678hexahydroquinoline3carboxylate
METHYL2AMINO4(4BROMOPHENYL)1(3CHLORO2METHYLPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBOXYLATE
MFCD01239740
ZINC000003664618
ZINC000003664619
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