N-[4-[[3-azanylpropyl-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-4-cyano-benzamide

Systemtic Name: N-[4-[[3-azanylpropyl-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-4-cyano-benzamide Openeye Name: N-[4-[[3-aminopropyl-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyano-benzamide CAS Name: N-[4-[[3-aminopropyl-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-4-cyanobenzamide IUPAC Name: N-[4-[[3-aminopropyl-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyanobenzamide Traditional Name: N-[4-[[3-aminopropyl-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyano-benzamide Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CCCN)C(=O)C2=CC=C(C=C2)C#N)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1CN(CCCN)C(=O)C2=CC=C(C=C2)C#N)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H23N5O2/c27-14-1-15-31(26(33)23-10-4-20(17-29)5-11-23)18-21-6-12-24(13-7-21)30-25(32)22-8-2-19(16-28)3-9-22/h2-13H,1,14-15,18,27H2,(H,30,32)