4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-(1-methyl-2-oxidanylidene-pyridin-3-yl)piperazine-1-carboxamide

Systemtic Name: 4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-(1-methyl-2-oxidanylidene-pyridin-3-yl)piperazine-1-carboxamide Openeye Name: 4-(2-amino-7-chloro-4-quinolyl)-N-(1-methyl-2-oxo-3-pyridyl)piperazine-1-carboxamide CAS Name: 4-(2-amino-7-chloro-4-quinolinyl)-N-(1-methyl-2-oxo-3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-(2-amino-7-chloroquinolin-4-yl)-N-(1-methyl-2-oxopyridin-3-yl)piperazine-1-carboxamide Traditional Name: 4-(2-amino-7-chloro-4-quinolyl)-N-(2-keto-1-methyl-3-pyridyl)piperazine-1-carboxamide Formula: C20H21ClN6O2 MolecularWeight: 412.87274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C(C1=O)NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

Isomeric SMILES

CN1C=CC=C(C1=O)NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

InChI

InChI=1S/C20H21ClN6O2/c1-25-6-2-3-15(19(25)28)24-20(29)27-9-7-26(8-10-27)17-12-18(22)23-16-11-13(21)4-5-14(16)17/h2-6,11-12H,7-10H2,1H3,(H2,22,23)(H,24,29)