3-[2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]-N-phenethyl-propanamide

Systemtic Name: 3-[2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]-N-phenethyl-propanamide Openeye Name: 3-[2-[(3-fluorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]-N-phenethyl-propanamide CAS Name: 3-[2-[(3-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]-N-phenethylpropanamide IUPAC Name: 3-[2-[(3-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]-N-phenethylpropanamide Traditional Name: 3-[2-[(3-fluorobenzyl)thio]-4-keto-quinazolin-3-yl]-N-phenethyl-propionamide Formula: C26H24FN3O2S MolecularWeight: 461.551063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H24FN3O2S/c27-21-10-6-9-20(17-21)18-33-26-29-23-12-5-4-11-22(23)25(32)30(26)16-14-24(31)28-15-13-19-7-2-1-3-8-19/h1-12,17H,13-16,18H2,(H,28,31)