6-chloranyl-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-chloranyl-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-chloro-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-chloro-N-[[3-(1-imidazolylmethyl)phenyl]methyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-chloro-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-chloro-N-[3-(imidazol-1-ylmethyl)benzyl]-4-keto-1H-quinoline-3-carboxamide Formula: C21H17ClN4O2 MolecularWeight: 392.83828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)Cl)CN4C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)Cl)CN4C=CN=C4

InChI

InChI=1S/C21H17ClN4O2/c22-16-4-5-19-17(9-16)20(27)18(11-24-19)21(28)25-10-14-2-1-3-15(8-14)12-26-7-6-23-13-26/h1-9,11,13H,10,12H2,(H,24,27)(H,25,28)