N-[(3-fluorophenyl)methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[(3-fluorophenyl)methyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[(3-fluorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[(3-fluorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(3-fluorobenzyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NCC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NCC3=CC(=CC=C3)F

InChI

InChI=1S/C18H16FN3O2S/c19-13-5-3-4-12(10-13)11-20-16(23)8-9-22-17(24)14-6-1-2-7-15(14)21-18(22)25/h1-7,10H,8-9,11H2,(H,20,23)(H,21,25)