2-acetamido-N-[4-[2-(tert-butylcarbamoyl)phenyl]-3-oxidanyl-1-phenylsulfanyl-butan-2-yl]butanediamide

Systemtic Name: 2-acetamido-N-[4-[2-(tert-butylcarbamoyl)phenyl]-3-oxidanyl-1-phenylsulfanyl-butan-2-yl]butanediamide Openeye Name: 2-acetamido-N-[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-(phenylsulfanylmethyl)propyl]butanediamide CAS Name: 2-acetamido-N-[4-[2-[(tert-butylamino)-oxomethyl]phenyl]-3-hydroxy-1-(phenylthio)butan-2-yl]butanediamide IUPAC Name: 2-acetamido-N-[4-[2-(tert-butylcarbamoyl)phenyl]-3-hydroxy-1-phenylsulfanylbutan-2-yl]butanediamide Traditional Name: 2-acetamido-N-[3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-1-[(phenylthio)methyl]propyl]succinamide Formula: C27H36N4O5S MolecularWeight: 528.66354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N)C(=O)NC(CSC1=CC=CC=C1)C(CC2=CC=CC=C2C(=O)NC(C)(C)C)O

Isomeric SMILES

CC(=O)NC(CC(=O)N)C(=O)NC(CSC1=CC=CC=C1)C(CC2=CC=CC=C2C(=O)NC(C)(C)C)O

InChI

InChI=1S/C27H36N4O5S/c1-17(32)29-21(15-24(28)34)26(36)30-22(16-37-19-11-6-5-7-12-19)23(33)14-18-10-8-9-13-20(18)25(35)31-27(2,3)4/h5-13,21-23,33H,14-16H2,1-4H3,(H2,28,34)(H,29,32)(H,30,36)(H,31,35)