2-[(4-cyanophenyl)methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]pentanediamide

Systemtic Name: 2-[(4-cyanophenyl)methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]pentanediamide Openeye Name: 2-[(4-cyanophenyl)methyl-[(5-phenylisoxazol-3-yl)methyl]amino]pentanediamide CAS Name: 2-[(4-cyanophenyl)methyl-[(5-phenyl-3-isoxazolyl)methyl]amino]pentanediamide IUPAC Name: 2-[(4-cyanophenyl)methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]pentanediamide Traditional Name: 2-[(4-cyanobenzyl)-[(5-phenylisoxazol-3-yl)methyl]amino]glutaramide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CN(CC3=CC=C(C=C3)C#N)C(CCC(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CN(CC3=CC=C(C=C3)C#N)C(CCC(=O)N)C(=O)N

InChI

InChI=1S/C23H23N5O3/c24-13-16-6-8-17(9-7-16)14-28(20(23(26)30)10-11-22(25)29)15-19-12-21(31-27-19)18-4-2-1-3-5-18/h1-9,12,20H,10-11,14-15H2,(H2,25,29)(H2,26,30)