2-[2-(4-chlorophenyl)sulfanylethylamino]-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethylamino]-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 2-[2-(4-chlorophenyl)sulfanylethylamino]-7-(2-thienyl)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 2-[2-[(4-chlorophenyl)thio]ethylamino]-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylethylamino]-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 2-[2-[(4-chlorophenyl)thio]ethylamino]-7-(2-thienyl)-7,8-dihydro-6H-quinazolin-5-one Formula: C20H18ClN3OS2 MolecularWeight: 415.95942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=CN=C(N=C21)NCCSC3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

C1C(CC(=O)C2=CN=C(N=C21)NCCSC3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C20H18ClN3OS2/c21-14-3-5-15(6-4-14)26-9-7-22-20-23-12-16-17(24-20)10-13(11-18(16)25)19-2-1-8-27-19/h1-6,8,12-13H,7,9-11H2,(H,22,23,24)