2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-3-(3-morpholinopropyl)quinazolin-4-one CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-3-[3-(4-morpholinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-3-(3-morpholinopropyl)quinazolin-4-one Formula: C23H26FN3O3S MolecularWeight: 443.534243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCN4CCOCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCN4CCOCC4)F

InChI

InChI=1S/C23H26FN3O3S/c1-29-21-8-7-17(15-19(21)24)16-31-23-25-20-6-3-2-5-18(20)22(28)27(23)10-4-9-26-11-13-30-14-12-26/h2-3,5-8,15H,4,9-14,16H2,1H3