2-oxidanylidene-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide

Systemtic Name: 2-oxidanylidene-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide Openeye Name: 2-oxo-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide CAS Name: 2-oxo-N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide IUPAC Name: 2-oxo-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide Traditional Name: 2-keto-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2CC(=O)NC3=CC=CC=C23)N4C=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2CC(=O)NC3=CC=CC=C23)N4C=CC=N4

InChI

InChI=1S/C22H21N5O3/c1-14(27-11-5-10-23-27)21(29)24-15-6-4-7-16(12-15)25-22(30)18-13-20(28)26-19-9-3-2-8-17(18)19/h2-12,14,18H,13H2,1H3,(H,24,29)(H,25,30)(H,26,28)