2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 2-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-3-(4-fluorophenyl)-4-quinazolinone IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-3-(4-fluorophenyl)quinazolin-4-one Formula: C23H17FN2O3S MolecularWeight: 420.456083

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

InChI

InChI=1S/C23H17FN2O3S/c24-15-5-7-16(8-6-15)26-22(25-19-4-2-1-3-18(19)23(26)27)14-30-17-9-10-20-21(13-17)29-12-11-28-20/h1-10,13H,11-12,14H2