Vitas-M small molecule compound
cyclohexyl 4-(2-chlorophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK364248
SMILES Clc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1Cl)C(=O)OC1CCCCC1)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 C29H29Cl2NO3 MW 510.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29Cl2NO3/c1-17-26(29(34)35-21-7-3-2-4-8-21)27(22-9-5-6-10-23(22)31)28-24(32-17)15-19(16-25(28)33)18-11-13-20(30)14-12-18/h5-6,9-14,19,21,27,32H,2-4,7-8,15-16H2,1H3InChIKey
YZGUKALYVHZALZ-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4Cl)C(=O)OC5CCCCC5
cyclohexyl4(2chlorophenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(2chlorophenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC29H29Cl2NO3c11726(29(34)35217324821)27(229561023(22)31)2824(3217)1519(1625(28)33)18111320(30)141218h5691419212732H24781516H21H3
MFCD01590152
ZINC000002927162
ZINC000002927167
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