N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]acetamide Formula: C23H17N3O5S MolecularWeight: 447.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CO5)OCO2

InChI

InChI=1S/C23H17N3O5S/c1-13(27)15-9-19-20(31-12-30-19)10-17(15)24-21(28)11-32-23-14-5-2-3-6-16(14)25-22(26-23)18-7-4-8-29-18/h2-10H,11-12H2,1H3,(H,24,28)