Vitas-M small molecule compound
3-cyclopentyl 6-methyl 4-(4-chlorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404666
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(cc1)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 C25H28ClNO5 MW 457.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClNO5/c1-13-12-18-22(23(28)19(13)24(29)31-3)21(15-8-10-16(26)11-9-15)20(14(2)27-18)25(30)32-17-6-4-5-7-17/h8-11,13,17,19,21,27H,4-7,12H2,1-3H3InChIKey
VGRIELWVEQPBKX-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl4(4chlorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl4(4chlorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCC3)C4=CC=C(C=C4)Cl)C(=O)C1C(=O)OC
InChI=1SC25H28ClNO5c113121822(23(28)19(13)24(29)313)21(1581016(26)11915)20(14(2)2718)25(30)3217645717h8111317192127H4712H213H3
MFCD05031580
ZINC000020569534
ZINC000239425799
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