2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-fluoranyl-2-nitro-phenyl)ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-fluoranyl-2-nitro-phenyl)ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-fluoro-2-nitro-phenyl)acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(4-fluoro-2-nitrophenyl)acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-fluoro-2-nitrophenyl)acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(4-fluoro-2-nitro-phenyl)acetamide Formula: C21H19FN4O4S MolecularWeight: 442.463363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C21H19FN4O4S/c22-13-9-10-17(18(11-13)26(29)30)23-19(27)12-31-21-24-16-8-4-3-7-15(16)20(28)25(21)14-5-1-2-6-14/h3-4,7-11,14H,1-2,5-6,12H2,(H,23,27)