ethyl 2-[[1-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]cyclopentyl]carbonylamino]-3-phenylmethoxy-propanoate

Systemtic Name: ethyl 2-[[1-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]cyclopentyl]carbonylamino]-3-phenylmethoxy-propanoate Openeye Name: ethyl 2-[[1-[(2-acetylsulfanyl-3-methyl-butanoyl)amino]cyclopentanecarbonyl]amino]-3-benzyloxy-propanoate CAS Name: 2-[[[1-[[2-(acetylthio)-3-methyl-1-oxobutyl]amino]cyclopentyl]-oxomethyl]amino]-3-phenylmethoxypropanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-[(2-acetylsulfanyl-3-methylbutanoyl)amino]cyclopentanecarbonyl]amino]-3-phenylmethoxypropanoate Traditional Name: 2-[[1-[[2-(acetylthio)-3-methyl-butanoyl]amino]cyclopentanecarbonyl]amino]-3-benzoxy-propionic acid ethyl ester Formula: C25H36N2O6S MolecularWeight: 492.62814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COCC1=CC=CC=C1)NC(=O)C2(CCCC2)NC(=O)C(C(C)C)SC(=O)C

Isomeric SMILES

CCOC(=O)C(COCC1=CC=CC=C1)NC(=O)C2(CCCC2)NC(=O)C(C(C)C)SC(=O)C

InChI

InChI=1S/C25H36N2O6S/c1-5-33-23(30)20(16-32-15-19-11-7-6-8-12-19)26-24(31)25(13-9-10-14-25)27-22(29)21(17(2)3)34-18(4)28/h6-8,11-12,17,20-21H,5,9-10,13-16H2,1-4H3,(H,26,31)(H,27,29)