N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(6-fluoro-2-phenyl-quinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(6-fluoro-2-phenyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(6-fluoro-2-phenylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(6-fluoro-2-phenyl-quinazolin-4-yl)thio]acetamide Formula: C25H19FN4O2S2 MolecularWeight: 490.572363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=NC4=C3C=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=NC4=C3C=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C25H19FN4O2S2/c1-2-32-17-9-11-20-21(13-17)34-25(28-20)29-22(31)14-33-24-18-12-16(26)8-10-19(18)27-23(30-24)15-6-4-3-5-7-15/h3-13H,2,14H2,1H3,(H,28,29,31)