Vitas-M small molecule compound
ethyl 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK673164
SMILES CCOC(=O)C1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1cc(OC)c(c(c1)OC)OC)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 C29H33ClN2O6 MW 541.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33ClN2O6/c1-7-38-28(34)25-23(16-12-21(35-4)26(37-6)22(13-16)36-5)24-19(14-29(2,3)15-20(24)33)32(27(25)31)18-10-8-17(30)9-11-18/h8-13,23H,7,14-15,31H2,1-6H3InChIKey
WCXWNBPUONBDED-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)CC(C2)(C)C)C4=CC=C(C=C4)Cl)N
ethyl2amino1(4chlorophenyl)77dimethyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
ETHYL2AMINO1(4CHLOROPHENYL)77DIMETHYL5OXO4(345TRIMETHOXYPHENYL)68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC29H33ClN2O6c173828(34)2523(161221(354)26(376)22(1316)365)2419(1429(23)1520(24)33)32(27(25)31)1810817(30)91118h81323H7141531H216H3
MFCD01113319
ZINC000001058150
ZINC000001058152
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