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

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(2-fluorophenyl)methylthio]-3-(4-methoxyphenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 2-[(2-fluorobenzyl)thio]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C27H24FN3O4S MolecularWeight: 505.560563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC=CC=C5F

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC=CC=C5F

InChI

InChI=1S/C27H24FN3O4S/c1-34-21-9-7-20(8-10-21)31-26(33)22-11-6-18(25(32)30-12-14-35-15-13-30)16-24(22)29-27(31)36-17-19-4-2-3-5-23(19)28/h2-11,16H,12-15,17H2,1H3