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

Systemtic Name: 2-oxidanylidene-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide Openeye Name: 2-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide CAS Name: 2-oxo-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide IUPAC Name: 2-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide Traditional Name: 2-keto-N-[2-(pyrazol-1-ylmethyl)benzyl]-1H-quinoline-3-carboxamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C21H18N4O2/c26-20(18-12-15-6-3-4-9-19(15)24-21(18)27)22-13-16-7-1-2-8-17(16)14-25-11-5-10-23-25/h1-12H,13-14H2,(H,22,26)(H,24,27)