3-[2,5-bis(chloranyl)phenyl]-2-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[2,5-bis(chloranyl)phenyl]-2-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-benzylsulfanyl-3-(2,5-dichlorophenyl)quinazolin-4-one CAS Name: 3-(2,5-dichlorophenyl)-2-(phenylmethylthio)-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-3-(2,5-dichlorophenyl)quinazolin-4-one Traditional Name: 2-(benzylthio)-3-(2,5-dichlorophenyl)quinazolin-4-one Formula: C21H14Cl2N2OS MolecularWeight: 413.31966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C21H14Cl2N2OS/c22-15-10-11-17(23)19(12-15)25-20(26)16-8-4-5-9-18(16)24-21(25)27-13-14-6-2-1-3-7-14/h1-12H,13H2