5-(4-azanyl-5-fluoranyl-spiro[1H-quinazoline-2,4'-piperidine]-1'-yl)carbonylisoindole-1,3-dione

Systemtic Name: 5-(4-azanyl-5-fluoranyl-spiro[1H-quinazoline-2,4'-piperidine]-1'-yl)carbonylisoindole-1,3-dione Openeye Name: 5-(4-amino-5-fluoro-spiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)isoindoline-1,3-dione CAS Name: 5-[(4-amino-5-fluoro-1'-spiro[1H-quinazoline-2,4'-piperidine]yl)-oxomethyl]isoindole-1,3-dione IUPAC Name: 5-(4-amino-5-fluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)isoindole-1,3-dione Traditional Name: 5-(4-amino-5-fluoro-spiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)isoindoline-1,3-quinone Formula: C21H18FN5O3 MolecularWeight: 407.397723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12NC3=C(C(=CC=C3)F)C(=N2)N)C(=O)C4=CC5=C(C=C4)C(=O)NC5=O

Isomeric SMILES

C1CN(CCC12NC3=C(C(=CC=C3)F)C(=N2)N)C(=O)C4=CC5=C(C=C4)C(=O)NC5=O

InChI

InChI=1S/C21H18FN5O3/c22-14-2-1-3-15-16(14)17(23)26-21(25-15)6-8-27(9-7-21)20(30)11-4-5-12-13(10-11)19(29)24-18(12)28/h1-5,10,25H,6-9H2,(H2,23,26)(H,24,28,29)