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

Systemtic Name: 4-(aminomethyl)-N-[2-phenyl-1-(4-phenylpyrimidin-2-yl)ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[2-phenyl-1-(4-phenylpyrimidin-2-yl)ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[2-phenyl-1-(4-phenyl-2-pyrimidinyl)ethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[2-phenyl-1-(4-phenylpyrimidin-2-yl)ethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[2-phenyl-1-(4-phenylpyrimidin-2-yl)ethyl]cyclohexanecarboxamide Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=NC=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=NC=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O/c27-18-20-11-13-22(14-12-20)26(31)30-24(17-19-7-3-1-4-8-19)25-28-16-15-23(29-25)21-9-5-2-6-10-21/h1-10,15-16,20,22,24H,11-14,17-18,27H2,(H,30,31)