2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(4-ethoxy-2-nitrophenyl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitrophenyl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(4-ethoxy-2-nitro-phenyl)acetamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S/c1-3-5-12-25-21(28)16-8-6-7-9-17(16)24-22(25)32-14-20(27)23-18-11-10-15(31-4-2)13-19(18)26(29)30/h6-11,13H,3-5,12,14H2,1-2H3,(H,23,27)