N-[2-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-4-cyano-benzamide

Systemtic Name: N-[2-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-4-cyano-benzamide Openeye Name: N-[2-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyano-benzamide CAS Name: N-[2-[[(3-amino-2,2-dimethylpropyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-4-cyanobenzamide IUPAC Name: N-[2-[[(3-amino-2,2-dimethylpropyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyanobenzamide Traditional Name: N-[2-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-4-cyano-benzamide Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(CN)CN(CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H27N5O2/c1-28(2,18-31)19-33(27(35)23-13-9-21(16-30)10-14-23)17-24-5-3-4-6-25(24)32-26(34)22-11-7-20(15-29)8-12-22/h3-14H,17-19,31H2,1-2H3,(H,32,34)