4-(aminomethyl)-N-[1-[4-(3-aminophenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(3-aminophenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(3-aminophenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(3-aminophenyl)-2-pyridinyl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(3-aminophenyl)pyridin-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[4-(3-aminophenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide Formula: C27H32N4O MolecularWeight: 428.56918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=NC=CC(=C3)C4=CC(=CC=C4)N

Isomeric SMILES

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=NC=CC(=C3)C4=CC(=CC=C4)N

InChI

InChI=1S/C27H32N4O/c28-18-20-9-11-21(12-10-20)27(32)31-26(15-19-5-2-1-3-6-19)25-17-23(13-14-30-25)22-7-4-8-24(29)16-22/h1-8,13-14,16-17,20-21,26H,9-12,15,18,28-29H2,(H,31,32)