N-(3-chloranyl-4-cyano-phenyl)-2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[7-chloro-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[[7-chloro-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[7-chloro-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[[7-chloro-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C22H14Cl2N4O3S MolecularWeight: 485.34256

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C22H14Cl2N4O3S/c23-14-4-6-17-19(8-14)27-22(28(21(17)30)11-16-2-1-7-31-16)32-12-20(29)26-15-5-3-13(10-25)18(24)9-15/h1-9H,11-12H2,(H,26,29)