N-(2-chloranyl-4-fluoranyl-phenyl)-2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[[2-(dimethylaminomethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[2-(dimethylaminomethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[[2-(dimethylaminomethyl)quinazolin-4-yl]thio]acetamide Formula: C19H18ClFN4OS MolecularWeight: 404.888823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CN(C)CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C19H18ClFN4OS/c1-25(2)10-17-22-15-6-4-3-5-13(15)19(24-17)27-11-18(26)23-16-8-7-12(21)9-14(16)20/h3-9H,10-11H2,1-2H3,(H,23,26)