(S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carboxylic acid 3-{3-[3-carboxy-4-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-phenyl]-thioureido}-propyl ester msds| properties| cas no| molecular formula | WorldOfChemicals

(S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carboxylic acid 3-{3-[3-carboxy-4-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-phenyl]-thioureido}-propyl ester Properties

(S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carboxylic acid 3-{3-[3-carboxy-4-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-phenyl]-thioureido}-propyl ester

Description

 

Chemical Properties

IUPAC Name (3E)-6-(3,6-Dihydroxy-9H-xanthen-9-ylidene)-3-({[3-({[(2S)-1-(4,4-dimethyl-2-oxopentanoyl)-2-piperidinyl]carbonyl}oxy)propyl]carbamothioyl}imino)-1,4-cyclohexadiene-1-carboxylic acid
InChI 1S/C37H39N3O9S/c1-37(2,3)20-29(43)33(44)40-15-5-4-7-28(40)35(47)48-16-6-14-38-36(50)39-21-8-11-24(27(17-21)34(45)46)32-25-12-9-22(41)18-30(25)49-31-19-23(42)10-13-26(31)32/h8-13,17-19,28,41-42H,4-7,14-16,20H2,1-3H3,(H,38,50)(H,45,46)/b39-21+/t28-/m0/s1
InChIKey OPKFEZVEEVXWRP-RFYLIDLWSA-N
Molar Mass 701.78 g/mol
Molecular Formula C37H39N3O9S
Synonyms (3E)-6-(3,6-Dihydroxy-9H-Xanthen-9-Ylidene)-3-{[(Z)-{[3-({[(2S)-1-(4,4-Dimethyl-2-Oxopentanoyl)Piperidin-2-Yl]Carbonyl}Oxy)Propyl]Imino}(Sulfanyl)Methyl]Imino}Cyclohexa-1,4-Diene-1-Carboxylic Acid;2-Piperidinecarboxylic Acid, 1-(4,4-Dimethyl-1,2-Dioxopentyl)-, 3-[[(1Z)-[[(1E)-3-Carboxy-4-(3,6-Dihydroxy-9H-Xanthen-9-Ylidene)-2,5-Cyclohexadien-1-Ylidene]Amino]Mercaptomethylene]Amino]Propyl Ester, (2S)-