2-[(3-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-3-(4-fluorophenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 2-[(3-chlorobenzyl)thio]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C26H21ClFN3O3S MolecularWeight: 509.979643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H21ClFN3O3S/c27-19-3-1-2-17(14-19)16-35-26-29-23-15-18(24(32)30-10-12-34-13-11-30)4-9-22(23)25(33)31(26)21-7-5-20(28)6-8-21/h1-9,14-15H,10-13,16H2