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

Systemtic Name: 4-(aminomethyl)-N-[2-phenyl-1-[4-(1H-pyrrol-3-yl)pyridin-2-yl]ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[2-phenyl-1-[4-(1H-pyrrol-3-yl)-2-pyridyl]ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[2-phenyl-1-[4-(1H-pyrrol-3-yl)-2-pyridinyl]ethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[2-phenyl-1-[4-(1H-pyrrol-3-yl)pyridin-2-yl]ethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[2-phenyl-1-[4-(1H-pyrrol-3-yl)-2-pyridyl]ethyl]cyclohexanecarboxamide Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O/c26-16-19-6-8-20(9-7-19)25(30)29-24(14-18-4-2-1-3-5-18)23-15-21(11-13-28-23)22-10-12-27-17-22/h1-5,10-13,15,17,19-20,24,27H,6-9,14,16,26H2,(H,29,30)