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

Systemtic Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-[(4-vinylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(4-ethenylphenyl)methylthio]-3-(4-fluorophenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-[(4-vinylbenzyl)thio]quinazolin-4-one Formula: C28H24FN3O3S MolecularWeight: 501.571863

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2C5=CC=C(C=C5)F

Isomeric SMILES

C=CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2C5=CC=C(C=C5)F

InChI

InChI=1S/C28H24FN3O3S/c1-2-19-3-5-20(6-4-19)18-36-28-30-25-17-21(26(33)31-13-15-35-16-14-31)7-12-24(25)27(34)32(28)23-10-8-22(29)9-11-23/h2-12,17H,1,13-16,18H2