2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-3-[(2-chlorophenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-3-[(2-chlorophenyl)methyl]quinazolin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-2-[(2,6-dichlorophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-2-[(2,6-dichlorophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-[(2,6-dichlorophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-chlorobenzyl)-2-[(2,6-dichlorobenzyl)thio]quinazolin-4-one Formula: C22H15Cl3N2OS MolecularWeight: 461.7913

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC=C4Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC=C4Cl)Cl)Cl

InChI

InChI=1S/C22H15Cl3N2OS/c23-17-8-3-1-6-14(17)12-27-21(28)15-7-2-4-11-20(15)26-22(27)29-13-16-18(24)9-5-10-19(16)25/h1-11H,12-13H2