4-[7-chloranyl-2-(phenylcarbamoylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[7-chloranyl-2-(phenylcarbamoylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(phenylcarbamoylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[2-[[anilino(oxo)methyl]amino]-7-chloro-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-(phenylcarbamoylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(phenylcarbamoylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C27H24ClFN6O2 MolecularWeight: 518.969863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NC(=O)NC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NC(=O)NC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)F

InChI

InChI=1S/C27H24ClFN6O2/c28-18-6-11-22-23(16-18)32-25(33-26(36)30-20-4-2-1-3-5-20)17-24(22)34-12-14-35(15-13-34)27(37)31-21-9-7-19(29)8-10-21/h1-11,16-17H,12-15H2,(H,31,37)(H2,30,32,33,36)