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

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(4-cyano-3-fluoranyl-phenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(4-cyano-3-fluoro-phenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(4-cyano-3-fluorophenyl)-2-pyridinyl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(4-cyano-3-fluorophenyl)pyridin-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[4-(4-cyano-3-fluoro-phenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide Formula: C28H29FN4O MolecularWeight: 456.554463

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C28H29FN4O/c29-25-15-22(10-11-24(25)18-31)23-12-13-32-26(16-23)27(14-19-4-2-1-3-5-19)33-28(34)21-8-6-20(17-30)7-9-21/h1-5,10-13,15-16,20-21,27H,6-9,14,17,30H2,(H,33,34)