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

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(4-cyanophenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(4-cyanophenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(4-cyanophenyl)-2-pyridinyl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(4-cyanophenyl)pyridin-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[4-(4-cyanophenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N4O/c29-18-21-6-10-23(11-7-21)25-14-15-31-26(17-25)27(16-20-4-2-1-3-5-20)32-28(33)24-12-8-22(19-30)9-13-24/h1-7,10-11,14-15,17,22,24,27H,8-9,12-13,16,19,30H2,(H,32,33)