N-[[5-[(7-chloranylquinolin-4-yl)amino]-2-oxidanyl-phenyl]methyl]-4-methyl-piperazine-1-carboxamide

Systemtic Name: N-[[5-[(7-chloranylquinolin-4-yl)amino]-2-oxidanyl-phenyl]methyl]-4-methyl-piperazine-1-carboxamide Openeye Name: N-[[5-[(7-chloro-4-quinolyl)amino]-2-hydroxy-phenyl]methyl]-4-methyl-piperazine-1-carboxamide CAS Name: N-[[5-[(7-chloro-4-quinolinyl)amino]-2-hydroxyphenyl]methyl]-4-methyl-1-piperazinecarboxamide IUPAC Name: N-[[5-[(7-chloroquinolin-4-yl)amino]-2-hydroxyphenyl]methyl]-4-methylpiperazine-1-carboxamide Traditional Name: N-[5-[(7-chloro-4-quinolyl)amino]-2-hydroxy-benzyl]-4-methyl-piperazine-1-carboxamide Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NCC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O

Isomeric SMILES

CN1CCN(CC1)C(=O)NCC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O

InChI

InChI=1S/C22H24ClN5O2/c1-27-8-10-28(11-9-27)22(30)25-14-15-12-17(3-5-21(15)29)26-19-6-7-24-20-13-16(23)2-4-18(19)20/h2-7,12-13,29H,8-11,14H2,1H3,(H,24,26)(H,25,30)