4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-(2-oxidanylidenepyrrolidin-3-yl)piperazine-1-carboxamide

Systemtic Name: 4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-(2-oxidanylidenepyrrolidin-3-yl)piperazine-1-carboxamide Openeye Name: 4-(2-amino-7-chloro-4-quinolyl)-N-(2-oxopyrrolidin-3-yl)piperazine-1-carboxamide CAS Name: 4-(2-amino-7-chloro-4-quinolinyl)-N-(2-oxo-3-pyrrolidinyl)-1-piperazinecarboxamide IUPAC Name: 4-(2-amino-7-chloroquinolin-4-yl)-N-(2-oxopyrrolidin-3-yl)piperazine-1-carboxamide Traditional Name: 4-(2-amino-7-chloro-4-quinolyl)-N-(2-ketopyrrolidin-3-yl)piperazine-1-carboxamide Formula: C18H21ClN6O2 MolecularWeight: 388.85134

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

Isomeric SMILES

C1CNC(=O)C1NC(=O)N2CCN(CC2)C3=CC(=NC4=C3C=CC(=C4)Cl)N

InChI

InChI=1S/C18H21ClN6O2/c19-11-1-2-12-14(9-11)22-16(20)10-15(12)24-5-7-25(8-6-24)18(27)23-13-3-4-21-17(13)26/h1-2,9-10,13H,3-8H2,(H2,20,22)(H,21,26)(H,23,27)