2-oxidanylidene-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-1H-quinoline-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-1H-quinoline-3-carboxamide Openeye Name: 2-oxo-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-1H-quinoline-3-carboxamide CAS Name: 2-oxo-N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]-1H-quinoline-3-carboxamide IUPAC Name: 2-oxo-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-1H-quinoline-3-carboxamide Traditional Name: 2-keto-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-1H-quinoline-3-carboxamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC3=CC=CC=C3NC2=O)N4C=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC3=CC=CC=C3NC2=O)N4C=CC=N4

InChI

InChI=1S/C22H19N5O3/c1-14(27-11-5-10-23-27)20(28)24-16-7-4-8-17(13-16)25-21(29)18-12-15-6-2-3-9-19(15)26-22(18)30/h2-14H,1H3,(H,24,28)(H,25,29)(H,26,30)