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

Systemtic Name: N-(3-chlorophenyl)-1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperidine-3-carboxamide Openeye Name: N-(3-chlorophenyl)-1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]piperidine-3-carboxamide CAS Name: N-(3-chlorophenyl)-1-[2-[[[(2-methyl-4-quinolinyl)amino]-oxomethyl]amino]ethyl]-3-piperidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperidine-3-carboxamide Traditional Name: N-(3-chlorophenyl)-1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]nipecotamide Formula: C25H28ClN5O2 MolecularWeight: 465.97512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCCC(C3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H28ClN5O2/c1-17-14-23(21-9-2-3-10-22(21)28-17)30-25(33)27-11-13-31-12-5-6-18(16-31)24(32)29-20-8-4-7-19(26)15-20/h2-4,7-10,14-15,18H,5-6,11-13,16H2,1H3,(H,29,32)(H2,27,28,30,33)