1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]-N-(3-phenylpropyl)piperidine-3-carboxamide

Systemtic Name: 1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]-N-(3-phenylpropyl)piperidine-3-carboxamide Openeye Name: 1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]-N-(3-phenylpropyl)piperidine-3-carboxamide CAS Name: 1-[2-[[[(2-methyl-4-quinolinyl)amino]-oxomethyl]amino]ethyl]-N-(3-phenylpropyl)-3-piperidinecarboxamide IUPAC Name: 1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]-N-(3-phenylpropyl)piperidine-3-carboxamide Traditional Name: 1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]-N-(3-phenylpropyl)nipecotamide Formula: C28H35N5O2 MolecularWeight: 473.6098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C28H35N5O2/c1-21-19-26(24-13-5-6-14-25(24)31-21)32-28(35)30-16-18-33-17-8-12-23(20-33)27(34)29-15-7-11-22-9-3-2-4-10-22/h2-6,9-10,13-14,19,23H,7-8,11-12,15-18,20H2,1H3,(H,29,34)(H2,30,31,32,35)