1-(7-chloranylquinolin-4-yl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide

Systemtic Name: 1-(7-chloranylquinolin-4-yl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide Openeye Name: 1-(7-chloro-4-quinolyl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide CAS Name: 1-(7-chloro-4-quinolinyl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide IUPAC Name: 1-(7-chloroquinolin-4-yl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide Traditional Name: 1-(7-chloro-4-quinolyl)-N-(4-fluorophenyl)-5H-1,4-diazepine-4-carboxamide Formula: C21H16ClFN4O MolecularWeight: 394.829343

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN(C=CN1C(=O)NC2=CC=C(C=C2)F)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1C=CN(C=CN1C(=O)NC2=CC=C(C=C2)F)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C21H16ClFN4O/c22-15-2-7-18-19(14-15)24-9-8-20(18)26-10-1-11-27(13-12-26)21(28)25-17-5-3-16(23)4-6-17/h1-10,12-14H,11H2,(H,25,28)