4-[2-[1-[[4-(aminomethyl)cyclohexyl]carbonylamino]-2-phenyl-ethyl]pyridin-4-yl]benzamide

Systemtic Name: 4-[2-[1-[[4-(aminomethyl)cyclohexyl]carbonylamino]-2-phenyl-ethyl]pyridin-4-yl]benzamide Openeye Name: 4-[2-[1-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-2-phenyl-ethyl]-4-pyridyl]benzamide CAS Name: 4-[2-[1-[[[4-(aminomethyl)cyclohexyl]-oxomethyl]amino]-2-phenylethyl]-4-pyridinyl]benzamide IUPAC Name: 4-[2-[1-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-2-phenylethyl]pyridin-4-yl]benzamide Traditional Name: 4-[2-[1-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-2-phenyl-ethyl]-4-pyridyl]benzamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C28H32N4O2/c29-18-20-6-8-23(9-7-20)28(34)32-26(16-19-4-2-1-3-5-19)25-17-24(14-15-31-25)21-10-12-22(13-11-21)27(30)33/h1-5,10-15,17,20,23,26H,6-9,16,18,29H2,(H2,30,33)(H,32,34)