2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-3-(4-fluorophenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C26H20ClF2N3O3S MolecularWeight: 527.970106

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=C(C=CC=C4Cl)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=C(C=CC=C4Cl)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H20ClF2N3O3S/c27-21-2-1-3-22(29)20(21)15-36-26-30-23-14-16(24(33)31-10-12-35-13-11-31)4-9-19(23)25(34)32(26)18-7-5-17(28)6-8-18/h1-9,14H,10-13,15H2