Vitas-M small molecule compound
cyclopentyl 4-(2-chlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363790
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccccc1)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 C28H28ClNO3 MW 461.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClNO3/c1-17-25(28(32)33-20-11-5-6-12-20)26(21-13-7-8-14-22(21)29)27-23(30-17)15-19(16-24(27)31)18-9-3-2-4-10-18/h2-4,7-10,13-14,19-20,26,30H,5-6,11-12,15-16H2,1H3InChIKey
PIHPOYKBHVBJPV-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Cl)C(=O)OC5CCCC5
cyclopentyl4(2chlorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
cyclopentyl4(2chlorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC28H28ClNO3c11725(28(32)332011561220)26(2113781422(21)29)2723(3017)1519(1624(27)31)1893241018h24710131419202630H5611121516H21H3
MFCD00771482
ZINC000002757825
ZINC000002757828
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