butyl 2-[[1-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]cyclopentyl]carbonylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: butyl 2-[[1-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]cyclopentyl]carbonylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: butyl 2-[[1-[(2-acetylsulfanyl-3-methyl-butanoyl)amino]cyclopentanecarbonyl]amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[[[1-[[2-(acetylthio)-3-methyl-1-oxobutyl]amino]cyclopentyl]-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid butyl ester IUPAC Name: butyl 2-[[1-[(2-acetylsulfanyl-3-methylbutanoyl)amino]cyclopentanecarbonyl]amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[[1-[[2-(acetylthio)-3-methyl-butanoyl]amino]cyclopentanecarbonyl]amino]-3-(4-hydroxyphenyl)propionic acid butyl ester Formula: C26H38N2O6S MolecularWeight: 506.65472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2(CCCC2)NC(=O)C(C(C)C)SC(=O)C

Isomeric SMILES

CCCCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2(CCCC2)NC(=O)C(C(C)C)SC(=O)C

InChI

InChI=1S/C26H38N2O6S/c1-5-6-15-34-24(32)21(16-19-9-11-20(30)12-10-19)27-25(33)26(13-7-8-14-26)28-23(31)22(17(2)3)35-18(4)29/h9-12,17,21-22,30H,5-8,13-16H2,1-4H3,(H,27,33)(H,28,31)