N-[(2S,3S,5R)-6-azanyl-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5R)-6-azanyl-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4R)-5-amino-1,4-dibenzyl-2-hydroxy-5-oxo-pentyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5R)-6-amino-3-hydroxy-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5R)-6-amino-5-benzyl-3-hydroxy-6-oxo-1-phenylhexan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4R)-5-amino-1,4-dibenzyl-2-hydroxy-5-keto-pentyl]quinoxaline-2-carboxamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(C(CC2=CC=CC=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)O)C(=O)N

InChI

InChI=1S/C28H28N4O3/c29-27(34)21(15-19-9-3-1-4-10-19)17-26(33)24(16-20-11-5-2-6-12-20)32-28(35)25-18-30-22-13-7-8-14-23(22)31-25/h1-14,18,21,24,26,33H,15-17H2,(H2,29,34)(H,32,35)/t21-,24+,26+/m1/s1