1-(6-chloranylpyridazin-3-yl)-N-(1-methyl-2-oxidanylidene-quinolin-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(1-methyl-2-oxidanylidene-quinolin-5-yl)piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(1-methyl-2-oxo-5-quinolyl)piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-(1-methyl-2-oxo-5-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(1-methyl-2-oxoquinolin-5-yl)piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(2-keto-1-methyl-5-quinolyl)isonipecotamide Formula: C20H20ClN5O2 MolecularWeight: 397.8581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC1=O)C(=CC=C2)NC(=O)C3CCN(CC3)C4=NN=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C=CC1=O)C(=CC=C2)NC(=O)C3CCN(CC3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C20H20ClN5O2/c1-25-16-4-2-3-15(14(16)5-8-19(25)27)22-20(28)13-9-11-26(12-10-13)18-7-6-17(21)23-24-18/h2-8,13H,9-12H2,1H3,(H,22,28)