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

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O5S/c1-3-11-24-20(27)15-7-5-6-8-16(15)23-21(24)31-13-19(26)22-17-10-9-14(30-4-2)12-18(17)25(28)29/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,26)