2-[(2,4-dichlorophenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one

Systemtic Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Openeye Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one CAS Name: 2-[(2,4-dichlorophenyl)methylthio]-3-(4-nitrophenyl)-4-quinazolinone IUPAC Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Traditional Name: 2-[(2,4-dichlorobenzyl)thio]-3-(4-nitrophenyl)quinazolin-4-one Formula: C21H13Cl2N3O3S MolecularWeight: 458.31722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13Cl2N3O3S/c22-14-6-5-13(18(23)11-14)12-30-21-24-19-4-2-1-3-17(19)20(27)25(21)15-7-9-16(10-8-15)26(28)29/h1-11H,12H2