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

Systemtic Name: 1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-benzyl-1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]piperidine-3-carboxamide CAS Name: 1-[2-[[[(2-methyl-4-quinolinyl)amino]-oxomethyl]amino]ethyl]-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperidine-3-carboxamide Traditional Name: N-benzyl-1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]nipecotamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2/c1-19-16-24(22-11-5-6-12-23(22)29-19)30-26(33)27-13-15-31-14-7-10-21(18-31)25(32)28-17-20-8-3-2-4-9-20/h2-6,8-9,11-12,16,21H,7,10,13-15,17-18H2,1H3,(H,28,32)(H2,27,29,30,33)