1-(4-fluorophenyl)carbonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(4-fluorobenzoyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(4-fluorobenzoyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-(4-fluorobenzoyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]isonipecotamide Formula: C29H27FN4O3 MolecularWeight: 498.548083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H27FN4O3/c30-23-12-10-21(11-13-23)28(36)33-16-14-22(15-17-33)29(37)34(18-20-6-2-1-3-7-20)19-26-31-25-9-5-4-8-24(25)27(35)32-26/h1-13,22H,14-19H2,(H,31,32,35)