Vitas-M small molecule compound
ethyl 2-amino-4-(4-ethylphenyl)-7,7-dimethyl-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK757810
SMILES CCOC(=O)C1=C(N)N(c2ccc(cc2)C)C2=C(C1c1ccc(cc1)CC)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 C29H34N2O3 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O3/c1-6-19-10-12-20(13-11-19)24-25-22(16-29(4,5)17-23(25)32)31(21-14-8-18(3)9-15-21)27(30)26(24)28(33)34-7-2/h8-15,24H,6-7,16-17,30H2,1-5H3InChIKey
VSSFZQWXOCEFRI-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)N(C(=C2C(=O)OCC)N)C4=CC=C(C=C4)C
ethyl2amino4(4ethylphenyl)77dimethyl1(4methylphenyl)5oxo145678hexahydroquinoline3carboxylate
ETHYL2AMINO4(4ETHYLPHENYL)77DIMETHYL1(4METHYLPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC29H34N2O3c1619101220(131119)242522(1629(45)1723(25)32)31(2114818(3)91521)27(30)26(24)28(33)3472h81524H67161730H215H3
MFCD01305067
ZINC000003666025
ZINC000003666026
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