3-(3-chloranyl-4-fluoranyl-phenyl)-2-[2-(2-chloranylphenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-2-[2-(2-chloranylphenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(2-chlorophenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(3-chloro-4-fluorophenyl)-2-[2-(2-chlorophenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-fluorophenyl)-2-[2-(2-chlorophenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(2-chlorophenoxy)ethylthio]quinazolin-4-one Formula: C22H15Cl2FN2O2S MolecularWeight: 461.336103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=CC=C3Cl)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=CC=C3Cl)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H15Cl2FN2O2S/c23-16-6-2-4-8-20(16)29-11-12-30-22-26-19-7-3-1-5-15(19)21(28)27(22)14-9-10-18(25)17(24)13-14/h1-10,13H,11-12H2