N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)quinoline-2-carboxamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)quinoline-2-carboxamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)quinoline-2-carboxamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-quinolinecarboxamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)quinoline-2-carboxamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)quinaldamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18N4O2/c1-14-19(21(27)25(24(14)2)16-9-4-3-5-10-16)23-20(26)18-13-12-15-8-6-7-11-17(15)22-18/h3-13H,1-2H3,(H,23,26)