N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C18H10F4N4OS2 MolecularWeight: 438.421813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C18H10F4N4OS2/c19-9-5-6-12-13(7-9)29-17(24-12)25-14(27)8-28-15-10-3-1-2-4-11(10)23-16(26-15)18(20,21)22/h1-7H,8H2,(H,24,25,27)