Vitas-M small molecule compound
propyl 4-[4-(benzyloxy)-3-methoxyphenyl]-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK022185
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)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 C34H34ClNO5 MW 572.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClNO5/c1-4-16-40-34(38)31-21(2)36-27-17-25(23-10-13-26(35)14-11-23)18-28(37)33(27)32(31)24-12-15-29(30(19-24)39-3)41-20-22-8-6-5-7-9-22/h5-15,19,25,32,36H,4,16-18,20H2,1-3H3InChIKey
KADXRKNJWRAPRV-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccc(cc1)Cl
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)CC(C2)C5=CC=C(C=C5)Cl)C
InChI=1SC34H34ClNO5c14164034(38)3121(2)36271725(23101326(35)141123)1828(37)33(27)32(31)24121529(30(1924)393)4120228657922h51519253236H4161820H213H3
MFCD01824409
propyl4(4(benzyloxy)3methoxyphenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl7(4chlorophenyl)4(3methoxy4phenylmethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK022185
ZINC000100575905
ZINC000100575915
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