N-[3-(4-fluorophenyl)sulfanylpropyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C21H22FN3O2S MolecularWeight: 399.481683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NCCCSC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NCCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2S/c22-16-8-10-17(11-9-16)28-14-4-12-23-20(26)7-3-13-25-15-24-19-6-2-1-5-18(19)21(25)27/h1-2,5-6,8-11,15H,3-4,7,12-14H2,(H,23,26)