N-[(2S,3S,5R)-5-aminocarbonyl-7-(dimethylamino)-3-oxidanyl-1-phenyl-heptan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5R)-5-aminocarbonyl-7-(dimethylamino)-3-oxidanyl-1-phenyl-heptan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4R)-1-benzyl-4-carbamoyl-6-(dimethylamino)-2-hydroxy-hexyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5R)-5-carbamoyl-7-(dimethylamino)-3-hydroxy-1-phenylheptan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5R)-5-carbamoyl-7-(dimethylamino)-3-hydroxy-1-phenylheptan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4R)-1-benzyl-4-carbamoyl-6-(dimethylamino)-2-hydroxy-hexyl]quinoxaline-2-carboxamide Formula: C25H31N5O3 MolecularWeight: 449.54534

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(CC(C(CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)N

Isomeric SMILES

CN(C)CC[C@H](C[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)N

InChI

InChI=1S/C25H31N5O3/c1-30(2)13-12-18(24(26)32)15-23(31)21(14-17-8-4-3-5-9-17)29-25(33)22-16-27-19-10-6-7-11-20(19)28-22/h3-11,16,18,21,23,31H,12-15H2,1-2H3,(H2,26,32)(H,29,33)/t18-,21+,23+/m1/s1