4-[4-[(7-chloranylquinolin-4-yl)amino]phenyl]sulfonyl-N-(3-fluoranyl-5-propoxy-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-[4-[(7-chloranylquinolin-4-yl)amino]phenyl]sulfonyl-N-(3-fluoranyl-5-propoxy-phenyl)piperazine-1-carboxamide Openeye Name: 4-[4-[(7-chloro-4-quinolyl)amino]phenyl]sulfonyl-N-(3-fluoro-5-propoxy-phenyl)piperazine-1-carboxamide CAS Name: 4-[4-[(7-chloro-4-quinolinyl)amino]phenyl]sulfonyl-N-(3-fluoro-5-propoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[4-[(7-chloroquinolin-4-yl)amino]phenyl]sulfonyl-N-(3-fluoro-5-propoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[4-[(7-chloro-4-quinolyl)amino]phenyl]sulfonyl-N-(3-fluoro-5-propoxy-phenyl)piperazine-1-carboxamide Formula: C29H29ClFN5O4S MolecularWeight: 598.088063

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)F

Isomeric SMILES

CCCOC1=CC(=CC(=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)F

InChI

InChI=1S/C29H29ClFN5O4S/c1-2-15-40-24-18-21(31)17-23(19-24)34-29(37)35-11-13-36(14-12-35)41(38,39)25-6-4-22(5-7-25)33-27-9-10-32-28-16-20(30)3-8-26(27)28/h3-10,16-19H,2,11-15H2,1H3,(H,32,33)(H,34,37)