7-chloranyl-3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-(4-chlorophenyl)-2-[(4-nitrobenzyl)thio]quinazolin-4-one Formula: C21H13Cl2N3O3S MolecularWeight: 458.31722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

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