2-[(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-(3,4-dichlorophenyl)quinazolin-4-one

Systemtic Name: 2-[(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-(3,4-dichlorophenyl)quinazolin-4-one Openeye Name: 2-[(6-chloro-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-(3,4-dichlorophenyl)quinazolin-4-one CAS Name: 2-[[(6-chloro-2-phenyl-4-quinazolinyl)thio]methyl]-3-(3,4-dichlorophenyl)-4-quinazolinone IUPAC Name: 2-[(6-chloro-2-phenylquinazolin-4-yl)sulfanylmethyl]-3-(3,4-dichlorophenyl)quinazolin-4-one Traditional Name: 2-[[(6-chloro-2-phenyl-quinazolin-4-yl)thio]methyl]-3-(3,4-dichlorophenyl)quinazolin-4-one Formula: C29H17Cl3N4OS MolecularWeight: 575.89548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC(=C(C=C6)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC(=C(C=C6)Cl)Cl

InChI

InChI=1S/C29H17Cl3N4OS/c30-18-10-13-25-21(14-18)28(35-27(34-25)17-6-2-1-3-7-17)38-16-26-33-24-9-5-4-8-20(24)29(37)36(26)19-11-12-22(31)23(32)15-19/h1-15H,16H2