Vitas-M small molecule compound
cyclohexyl 7-(4-chlorophenyl)-4-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK017130
SMILES COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OC1CCCCC1
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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 C30H32ClNO4 MW 506.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32ClNO4/c1-18-27(30(34)36-23-8-4-3-5-9-23)28(20-7-6-10-24(15-20)35-2)29-25(32-18)16-21(17-26(29)33)19-11-13-22(31)14-12-19/h6-7,10-15,21,23,28,32H,3-5,8-9,16-17H2,1-2H3InChIKey
DKDMMELIASVPAY-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)OC)C(=O)OC5CCCCC5
COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OC1CCCCC1
cyclohexyl7(4chlorophenyl)4(3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl7(4chlorophenyl)4(3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC30H32ClNO4c11827(30(34)36238435923)28(20761024(1520)352)2925(3218)1621(1726(29)33)19111322(31)141219h67101521232832H35891617H212H3
MFCD01824306
STK017130
ZINC000002923144
ZINC000002923158
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