N-(2-cyano-1-benzofuran-3-yl)-2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C25H15FN4O3S MolecularWeight: 470.475003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H15FN4O3S/c26-15-9-11-16(12-10-15)30-24(32)17-5-1-3-7-19(17)28-25(30)34-14-22(31)29-23-18-6-2-4-8-20(18)33-21(23)13-27/h1-12H,14H2,(H,29,31)