4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-[3-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-[3-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide Openeye Name: 4-(2-amino-7-chloro-4-quinolyl)-N-[3-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide CAS Name: 4-(2-amino-7-chloro-4-quinolinyl)-N-[3-(methylcarbamoyl)cyclohexyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-amino-7-chloroquinolin-4-yl)-N-[3-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide Traditional Name: 4-(2-amino-7-chloro-4-quinolyl)-N-[3-(methylcarbamoyl)cyclohexyl]piperazine-1-carboxamide Formula: C22H29ClN6O2 MolecularWeight: 444.95766

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCCC(C1)NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

Isomeric SMILES

CNC(=O)C1CCCC(C1)NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

InChI

InChI=1S/C22H29ClN6O2/c1-25-21(30)14-3-2-4-16(11-14)26-22(31)29-9-7-28(8-10-29)19-13-20(24)27-18-12-15(23)5-6-17(18)19/h5-6,12-14,16H,2-4,7-11H2,1H3,(H2,24,27)(H,25,30)(H,26,31)