1-[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-2-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]piperidine-4-carboxamide CAS Name: 1-[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-N-[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-2-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-1-benzyl-2-keto-ethyl]-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]isonipecotamide Formula: C33H39N5O5 MolecularWeight: 585.69326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)N)C(=O)C(CC4=CC=C(C=C4)O)N

Isomeric SMILES

C1CN(CCC1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)C(=O)[C@H](CC4=CC=C(C=C4)O)N

InChI

InChI=1S/C33H39N5O5/c34-27(19-24-11-13-26(39)14-12-24)33(43)38-17-15-25(16-18-38)31(41)37-29(21-23-9-5-2-6-10-23)32(42)36-28(30(35)40)20-22-7-3-1-4-8-22/h1-14,25,27-29,39H,15-21,34H2,(H2,35,40)(H,36,42)(H,37,41)/t27-,28-,29-/m0/s1