Vitas-M small molecule compound
3-cyclopentyl 6-methyl 4-(3,4-dichlorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404883
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(c(c1)Cl)Cl)C(=C(N2)C)C(=O)OC1CCCC1
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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 C25H27Cl2NO5 MW 492.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27Cl2NO5/c1-12-10-18-22(23(29)19(12)24(30)32-3)21(14-8-9-16(26)17(27)11-14)20(13(2)28-18)25(31)33-15-6-4-5-7-15/h8-9,11-12,15,19,21,28H,4-7,10H2,1-3H3InChIKey
XQGNXCNTKJGAAO-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl4(34dichlorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl4(34dichlorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCC3)C4=CC(=C(C=C4)Cl)Cl)C(=O)C1C(=O)OC
InChI=1SC25H27Cl2NO5c112101822(23(29)19(12)24(30)323)21(148916(26)17(27)1114)20(13(2)2818)25(31)3315645715h89111215192128H4710H213H3
MFCD05996213
ZINC000016383116
ZINC000239433408
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