Vitas-M small molecule compound
cyclopentyl 4-(2,4-dichlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK074250
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(cc1Cl)Cl)C(=O)OC1CCCC1)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 C29H29Cl2NO4 MW 526.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29Cl2NO4/c1-16-26(29(34)36-21-5-3-4-6-21)27(22-12-9-19(30)15-23(22)31)28-24(32-16)13-18(14-25(28)33)17-7-10-20(35-2)11-8-17/h7-12,15,18,21,27,32H,3-6,13-14H2,1-2H3InChIKey
UEAVJGVLWKYQJG-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=C(C=C(C=C4)Cl)Cl)C(=O)OC5CCCC5
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(cc1Cl)Cl)C(=O)OC1CCCC1)C
cyclopentyl4(24dichlorophenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(24dichlorophenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC29H29Cl2NO4c11626(29(34)3621534621)27(2212919(30)1523(22)31)2824(3216)1318(1425(28)33)1771020(352)11817h7121518212732H361314H212H3
MFCD01824410
STK074250
ZINC000002757430
ZINC000002757433
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