N-(2-fluorophenyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: N-(2-fluorophenyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: N-(2-fluorophenyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: N-(2-fluorophenyl)-3-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: N-(2-fluorophenyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: N-(2-fluorophenyl)-3-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C18H13F4N3OS MolecularWeight: 395.373933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C18H13F4N3OS/c19-12-6-2-4-8-14(12)23-15(26)9-10-27-16-11-5-1-3-7-13(11)24-17(25-16)18(20,21)22/h1-8H,9-10H2,(H,23,26)