Vitas-M small molecule compound
cyclopentyl 4-(2-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK378061
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1F)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 C28H28FNO3 MW 445.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28FNO3/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
GSKDVKZRDSPPOD-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4F)C(=O)OC5CCCC5
cyclopentyl4(2fluorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
cyclopentyl4(2fluorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC28H28FNO3c11725(28(32)332011561220)26(2113781422(21)29)2723(3017)1519(1624(27)31)1893241018h24710131419202630H5611121516H21H3
MFCD01655991
ZINC000019643578
ZINC000019643587
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