1-[1-[(2-azanyl-3-sulfanyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butyl]-N-tert-butyl-piperidine-2-carboxamide

Systemtic Name: 1-[1-[(2-azanyl-3-sulfanyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butyl]-N-tert-butyl-piperidine-2-carboxamide Openeye Name: 1-[1-[(2-amino-3-sulfanyl-propanoyl)amino]-2-hydroxy-4-phenyl-butyl]-N-tert-butyl-piperidine-2-carboxamide CAS Name: 1-[1-[(2-amino-3-mercapto-1-oxopropyl)amino]-2-hydroxy-4-phenylbutyl]-N-tert-butyl-2-piperidinecarboxamide IUPAC Name: 1-[1-[(2-amino-3-sulfanylpropanoyl)amino]-2-hydroxy-4-phenylbutyl]-N-tert-butylpiperidine-2-carboxamide Traditional Name: 1-[1-[(2-amino-3-mercapto-propanoyl)amino]-2-hydroxy-4-phenyl-butyl]-N-tert-butyl-pipecolinamide Formula: C23H38N4O3S MolecularWeight: 450.63782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CCCCN1C(C(CCC2=CC=CC=C2)O)NC(=O)C(CS)N

Isomeric SMILES

CC(C)(C)NC(=O)C1CCCCN1C(C(CCC2=CC=CC=C2)O)NC(=O)C(CS)N

InChI

InChI=1S/C23H38N4O3S/c1-23(2,3)26-22(30)18-11-7-8-14-27(18)20(25-21(29)17(24)15-31)19(28)13-12-16-9-5-4-6-10-16/h4-6,9-10,17-20,28,31H,7-8,11-15,24H2,1-3H3,(H,25,29)(H,26,30)