6-azanyl-1-methyl-4-oxidanylidene-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxamide

Systemtic Name: 6-azanyl-1-methyl-4-oxidanylidene-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxamide Openeye Name: 6-amino-1-methyl-4-oxo-7-[4-(2-pyridyl)piperazin-1-yl]quinoline-3-carboxamide CAS Name: 6-amino-1-methyl-4-oxo-7-[4-(2-pyridinyl)-1-piperazinyl]-3-quinolinecarboxamide IUPAC Name: 6-amino-1-methyl-4-oxo-7-(4-pyridin-2-ylpiperazin-1-yl)quinoline-3-carboxamide Traditional Name: 6-amino-4-keto-1-methyl-7-[4-(2-pyridyl)piperazino]quinoline-3-carboxamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4=CC=CC=N4)N)C(=O)N

Isomeric SMILES

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4=CC=CC=N4)N)C(=O)N

InChI

InChI=1S/C20H22N6O2/c1-24-12-14(20(22)28)19(27)13-10-15(21)17(11-16(13)24)25-6-8-26(9-7-25)18-4-2-3-5-23-18/h2-5,10-12H,6-9,21H2,1H3,(H2,22,28)