2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(6-fluoro-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[(6-fluoro-2-phenyl-4-quinazolinyl)thio]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-(6-fluoro-2-phenylquinazolin-4-yl)sulfanyl-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[(6-fluoro-2-phenyl-quinazolin-4-yl)thio]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C23H17FN4O3S MolecularWeight: 448.469483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H17FN4O3S/c1-14-7-9-17(28(30)31)12-20(14)25-21(29)13-32-23-18-11-16(24)8-10-19(18)26-22(27-23)15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,25,29)