Vitas-M small molecule compound
2-phenylethyl 7-(4-chlorophenyl)-2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK036729
SMILES CC(Oc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCc1ccccc1)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 C34H34ClNO4 MW 556.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClNO4/c1-21(2)40-30-12-8-7-11-27(30)32-31(34(38)39-18-17-23-9-5-4-6-10-23)22(3)36-28-19-25(20-29(37)33(28)32)24-13-15-26(35)16-14-24/h4-16,21,25,32,36H,17-20H2,1-3H3InChIKey
OAKSUYZJRUMOEN-UHFFFAOYSA-NSynonyms
2phenylethyl7(4chlorophenyl)2methyl5oxo4(2(propan2yloxy)phenyl)145678hexahydroquinoline3carboxylate
2phenylethyl7(4chlorophenyl)2methyl5oxo4(2propan2yloxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CC(Oc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCc1ccccc1)C
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4OC(C)C)C(=O)OCCC5=CC=CC=C5
InChI=1SC34H34ClNO4c121(2)403012871127(30)3231(34(38)3918172395461023)22(3)36281925(2029(37)33(28)32)24131526(35)161424h41621253236H1720H213H3
MFCD01528057
STK036729
ZINC000100554390
ZINC000100554400
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