N-(2-azanylcyclohexyl)-N-[(3-benzamidophenyl)methyl]-4-cyano-benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[(3-benzamidophenyl)methyl]-4-cyano-benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-4-cyano-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-4-cyanobenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[(3-benzamidophenyl)methyl]-4-cyanobenzamide Traditional Name: N-(2-aminocyclohexyl)-N-(3-benzamidobenzyl)-4-cyano-benzamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H28N4O2/c29-18-20-13-15-23(16-14-20)28(34)32(26-12-5-4-11-25(26)30)19-21-7-6-10-24(17-21)31-27(33)22-8-2-1-3-9-22/h1-3,6-10,13-17,25-26H,4-5,11-12,19,30H2,(H,31,33)