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

Systemtic Name: butyl 3-(4-hydroxyphenyl)-2-[[1-[(3-methyl-2-sulfanyl-butanoyl)amino]cyclopentyl]carbonylamino]propanoate Openeye Name: butyl 3-(4-hydroxyphenyl)-2-[[1-[(3-methyl-2-sulfanyl-butanoyl)amino]cyclopentanecarbonyl]amino]propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[[1-[(2-mercapto-3-methyl-1-oxobutyl)amino]cyclopentyl]-oxomethyl]amino]propanoic acid butyl ester IUPAC Name: butyl 3-(4-hydroxyphenyl)-2-[[1-[(3-methyl-2-sulfanylbutanoyl)amino]cyclopentanecarbonyl]amino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[[1-[(2-mercapto-3-methyl-butanoyl)amino]cyclopentanecarbonyl]amino]propionic acid butyl ester Formula: C24H36N2O5S MolecularWeight: 464.61804

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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)S

Isomeric SMILES

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

InChI

InChI=1S/C24H36N2O5S/c1-4-5-14-31-22(29)19(15-17-8-10-18(27)11-9-17)25-23(30)24(12-6-7-13-24)26-21(28)20(32)16(2)3/h8-11,16,19-20,27,32H,4-7,12-15H2,1-3H3,(H,25,30)(H,26,28)