1-(1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]ethanone Formula: C21H14N2O4S MolecularWeight: 390.41186

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C21H14N2O4S/c24-16(13-7-8-17-19(10-13)27-12-26-17)11-28-21-14-4-1-2-5-15(14)22-20(23-21)18-6-3-9-25-18/h1-10H,11-12H2