N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]acetamide Formula: C22H18ClN3O4S MolecularWeight: 455.91402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)Cl)OC

InChI

InChI=1S/C22H18ClN3O4S/c1-28-18-11-19(29-2)16(10-14(18)23)24-20(27)12-31-22-13-6-3-4-7-15(13)25-21(26-22)17-8-5-9-30-17/h3-11H,12H2,1-2H3,(H,24,27)