2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-benzo[g]quinazolin-4-one

Systemtic Name: 2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-benzo[g]quinazolin-4-one Openeye Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-benzo[g]quinazolin-4-one CAS Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-methyl-4-benzo[g]quinazolinone IUPAC Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methylbenzo[g]quinazolin-4-one Traditional Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-methyl-benzo[g]quinazolin-4-one Formula: C22H17FN2O3S MolecularWeight: 408.445383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC4=C5C(=CC(=C4)F)COCO5

Isomeric SMILES

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC4=C5C(=CC(=C4)F)COCO5

InChI

InChI=1S/C22H17FN2O3S/c1-25-21(26)18-8-13-4-2-3-5-14(13)9-19(18)24-22(25)29-11-16-7-17(23)6-15-10-27-12-28-20(15)16/h2-9H,10-12H2,1H3