3-[2,6-bis(chloranyl)phenyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-(2,6-dichlorophenyl)-2-[(4-oxo-1H-quinazolin-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-(2,6-dichlorophenyl)-2-[[(4-oxo-1H-quinazolin-2-yl)thio]methyl]-4-quinazolinone IUPAC Name: 3-(2,6-dichlorophenyl)-2-[(4-oxo-1H-quinazolin-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-(2,6-dichlorophenyl)-2-[[(4-keto-1H-quinazolin-2-yl)thio]methyl]quinazolin-4-one Formula: C23H14Cl2N4O2S MolecularWeight: 481.35386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)SCC3=NC4=CC=CC=C4C(=O)N3C5=C(C=CC=C5Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)SCC3=NC4=CC=CC=C4C(=O)N3C5=C(C=CC=C5Cl)Cl

InChI

InChI=1S/C23H14Cl2N4O2S/c24-15-8-5-9-16(25)20(15)29-19(26-18-11-4-2-7-14(18)22(29)31)12-32-23-27-17-10-3-1-6-13(17)21(30)28-23/h1-11H,12H2,(H,27,28,30)