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

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]acetamide Formula: C21H18Cl2FN3O3S MolecularWeight: 482.355323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C21H18Cl2FN3O3S/c22-12-3-5-15-18(8-12)26-21(27(20(15)29)10-14-2-1-7-30-14)31-11-19(28)25-17-6-4-13(24)9-16(17)23/h3-6,8-9,14H,1-2,7,10-11H2,(H,25,28)