N-[(2S,3S,5S)-6-azanyl-5-(2,6-dimethyloxan-4-yl)-3-oxidanyl-6-oxidanylidene-1-phenyl-hexan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5S)-6-azanyl-5-(2,6-dimethyloxan-4-yl)-3-oxidanyl-6-oxidanylidene-1-phenyl-hexan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4S)-5-amino-1-benzyl-4-(2,6-dimethyltetrahydropyran-4-yl)-2-hydroxy-5-oxo-pentyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5S)-6-amino-5-(2,6-dimethyl-4-oxanyl)-3-hydroxy-6-oxo-1-phenylhexan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5S)-6-amino-5-(2,6-dimethyloxan-4-yl)-3-hydroxy-6-oxo-1-phenylhexan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4S)-5-amino-1-benzyl-4-(2,6-dimethyltetrahydropyran-4-yl)-2-hydroxy-5-keto-pentyl]quinoxaline-2-carboxamide Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(O1)C)C(CC(C(CC2=CC=CC=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)O)C(=O)N

Isomeric SMILES

CC1CC(CC(O1)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/C28H34N4O4/c1-17-12-20(13-18(2)36-17)21(27(29)34)15-26(33)24(14-19-8-4-3-5-9-19)32-28(35)25-16-30-22-10-6-7-11-23(22)31-25/h3-11,16-18,20-21,24,26,33H,12-15H2,1-2H3,(H2,29,34)(H,32,35)/t17?,18?,20?,21-,24-,26-/m0/s1