4-(aminomethyl)-N-[1-[4-(6-azanylpyridin-3-yl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(6-azanylpyridin-3-yl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(6-amino-3-pyridyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(6-amino-3-pyridinyl)-2-pyridinyl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(6-aminopyridin-3-yl)pyridin-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[4-(6-amino-3-pyridyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N5O/c27-16-19-6-8-20(9-7-19)26(32)31-24(14-18-4-2-1-3-5-18)23-15-21(12-13-29-23)22-10-11-25(28)30-17-22/h1-5,10-13,15,17,19-20,24H,6-9,14,16,27H2,(H2,28,30)(H,31,32)