7-chloranyl-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(furan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(furan-2-ylmethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(2-furylmethyl)quinazolin-4-one CAS Name: 7-chloro-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-(2-furanylmethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(furan-2-ylmethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-(2-furfuryl)quinazolin-4-one Formula: C22H16ClFN2O4S MolecularWeight: 458.889843

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CO5)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CO5)F

InChI

InChI=1S/C22H16ClFN2O4S/c23-15-3-4-18-19(8-15)25-22(26(21(18)27)9-17-2-1-5-29-17)31-11-14-7-16(24)6-13-10-28-12-30-20(13)14/h1-8H,9-12H2