N-[(4-fluorophenyl)methyl]-4-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperazine-1-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperazine-1-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]piperazine-1-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-4-[2-[[[(2-methyl-4-quinolinyl)amino]-oxomethyl]amino]ethyl]-1-piperazinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]piperazine-1-carboxamide Traditional Name: N-(4-fluorobenzyl)-4-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]piperazine-1-carboxamide Formula: C25H29FN6O2 MolecularWeight: 464.535163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCN(CC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H29FN6O2/c1-18-16-23(21-4-2-3-5-22(21)29-18)30-24(33)27-10-11-31-12-14-32(15-13-31)25(34)28-17-19-6-8-20(26)9-7-19/h2-9,16H,10-15,17H2,1H3,(H,28,34)(H2,27,29,30,33)