4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-azanyl-7-chloranyl-quinolin-4-yl)-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxamide Openeye Name: 4-(2-amino-7-chloro-4-quinolyl)-N-[2-(dimethylamino)-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: 4-(2-amino-7-chloro-4-quinolinyl)-N-[2-(dimethylamino)-2-oxoethyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-amino-7-chloroquinolin-4-yl)-N-[2-(dimethylamino)-2-oxoethyl]piperazine-1-carboxamide Traditional Name: 4-(2-amino-7-chloro-4-quinolyl)-N-[2-(dimethylamino)-2-keto-ethyl]piperazine-1-carboxamide Formula: C18H23ClN6O2 MolecularWeight: 390.86722

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=CC(=C3)Cl)N

Isomeric SMILES

CN(C)C(=O)CNC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=CC(=C3)Cl)N

InChI

InChI=1S/C18H23ClN6O2/c1-23(2)17(26)11-21-18(27)25-7-5-24(6-8-25)15-10-16(20)22-14-9-12(19)3-4-13(14)15/h3-4,9-10H,5-8,11H2,1-2H3,(H2,20,22)(H,21,27)