(S)-1-{(2R,3S)-2-Hydroxy-3-[(R)-3-methyl-2-(3-methyl-3-thiazol-5-ylmethyl-ureido)-butyrylamino]-4-phenyl-butyl}-4-thiazol-5-ylmethyl-piperazine-2-carboxylic acid tert-butylamide Properties, Molecular Formula, Applications - WorldOfChemicals

(S)-1-{(2R,3S)-2-Hydroxy-3-[(R)-3-methyl-2-(3-methyl-3-thiazol-5-ylmethyl-ureido)-butyrylamino]-4-phenyl-butyl}-4-thiazol-5-ylmethyl-piperazine-2-carboxylic acid tert-butylamide Properties

(S)-1-{(2R,3S)-2-Hydroxy-3-[(R)-3-methyl-2-(3-methyl-3-thiazol-5-ylmethyl-ureido)-butyrylamino]-4-phenyl-butyl}-4-thiazol-5-ylmethyl-piperazine-2-carboxylic acid tert-butylamide

Molecule Structure Image

Description

 

Chemical Properties

IUPAC Name (2S)-1-[(2R,3S)-2-Hydroxy-3-({N-[methyl(1,3-thiazol-5-ylmethyl)carbamoyl]-D-valyl}amino)-4-phenylbutyl]-N-(2-methyl-2-propanyl)-4-(1,3-thiazol-5-ylmethyl)-2-piperazinecarboxamide
InChI 1S/C34H50N8O4S2/c1-23(2)30(38-33(46)40(6)17-25-15-35-21-47-25)32(45)37-27(14-24-10-8-7-9-11-24)29(43)20-42-13-12-41(18-26-16-36-22-48-26)19-28(42)31(44)39-34(3,4)5/h7-11,15-16,21-23,27-30,43H,12-14,17-20H2,1-6H3,(H,37,45)(H,38,46)(H,39,44)/t27-,28-,29+,30+/m0/s1
InChIKey NKWHEVVBYAUGES-VZNYXHRGSA-N
Molar Mass 698.94 g/mol
Molecular Formula C34H50N8O4S2
Refractive 1.594 n/D
Synonyms (2S)-N-Tert-Butyl-1-[(2R,3S)-2-Hydroxy-3-({N-[Methyl(1,3-Thiazol-5-Ylmethyl)Carbamoyl]-D-Valyl}Amino)-4-Phenylbutyl]-4-(1,3-Thiazol-5-Ylmethyl)Piperazine-2-Carboxamide;2R)-N-((1S,2R)-3-{2-[N-(Tert-Butyl)Carbamoyl]-4-(1,3-Thiazol-5-Ylmethyl)Piperazinyl}-2-Hydroxy-1-Benzylpropyl)-3-Methyl-2-{[N-Methyl-N-(1,3-Thiazol-5-Ylmethyl)Carbamoyl]Amino}Butanamide