2-[6-fluoranyl-2-(4-methylphenyl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[6-fluoranyl-2-(4-methylphenyl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[6-fluoro-2-(p-tolyl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)acetamide CAS Name: 2-[[6-fluoro-2-(4-methylphenyl)-4-quinazolinyl]thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[6-fluoro-2-(4-methylphenyl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)acetamide Traditional Name: 2-[[6-fluoro-2-(p-tolyl)quinazolin-4-yl]thio]-N-(3-nitrophenyl)acetamide Formula: C23H17FN4O3S MolecularWeight: 448.469483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=N2)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=N2)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

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