3-[(2-chlorophenyl)methyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(2-chlorophenyl)methyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-chlorobenzyl)-2-[(4-keto-1H-quinazolin-2-yl)methylthio]quinazolin-4-one Formula: C24H17ClN4O2S MolecularWeight: 460.93538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=O)C5=CC=CC=C5N4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=O)C5=CC=CC=C5N4)Cl

InChI

InChI=1S/C24H17ClN4O2S/c25-18-10-4-1-7-15(18)13-29-23(31)17-9-3-6-12-20(17)27-24(29)32-14-21-26-19-11-5-2-8-16(19)22(30)28-21/h1-12H,13-14H2,(H,26,28,30)