N1-[(2S,3R)-4-[(2-methylphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[(2S,3R)-4-[(2-methylphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2R)-1-benzyl-2-hydroxy-3-(o-tolylmethylamino)propyl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3R)-3-hydroxy-4-[(2-methylphenyl)methylamino]-1-phenylbutan-2-yl]-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3R)-3-hydroxy-4-[(2-methylphenyl)methylamino]-1-phenylbutan-2-yl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[(2-methylbenzyl)amino]propyl]-N',N'-dipropyl-isophthalamide Formula: C32H41N3O3 MolecularWeight: 515.68624

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CNCC3=CC=CC=C3C)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CNCC3=CC=CC=C3C)O

InChI

InChI=1S/C32H41N3O3/c1-4-18-35(19-5-2)32(38)27-17-11-16-26(21-27)31(37)34-29(20-25-13-7-6-8-14-25)30(36)23-33-22-28-15-10-9-12-24(28)3/h6-17,21,29-30,33,36H,4-5,18-20,22-23H2,1-3H3,(H,34,37)/t29-,30+/m0/s1