1-(4-fluorophenyl)carbonyl-N-(4-oxidanylidenequinazolin-3-yl)piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-(4-oxidanylidenequinazolin-3-yl)piperidine-3-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-(4-oxoquinazolin-3-yl)piperidine-3-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-(4-oxo-3-quinazolinyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-(4-oxoquinazolin-3-yl)piperidine-3-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-(4-ketoquinazolin-3-yl)nipecotamide Formula: C21H19FN4O3 MolecularWeight: 394.398963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19FN4O3/c22-16-9-7-14(8-10-16)20(28)25-11-3-4-15(12-25)19(27)24-26-13-23-18-6-2-1-5-17(18)21(26)29/h1-2,5-10,13,15H,3-4,11-12H2,(H,24,27)