3-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-fluoranylphenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-fluoranylphenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-fluorophenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-fluorophenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-fluorophenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 2-[2-(2-fluorophenoxy)ethylthio]-3-veratryl-quinazolin-4-one Formula: C25H23FN2O4S MolecularWeight: 466.524523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=CC=C4F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=CC=C4F)OC

InChI

InChI=1S/C25H23FN2O4S/c1-30-22-12-11-17(15-23(22)31-2)16-28-24(29)18-7-3-5-9-20(18)27-25(28)33-14-13-32-21-10-6-4-8-19(21)26/h3-12,15H,13-14,16H2,1-2H3