2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-(7-chloro-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitro-phenyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propyl-2-quinazolinyl)thio]-N-(4-ethoxy-2-nitrophenyl)acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-(4-ethoxy-2-nitrophenyl)acetamide Traditional Name: 2-[(7-chloro-4-keto-3-propyl-quinazolin-2-yl)thio]-N-(4-ethoxy-2-nitro-phenyl)acetamide Formula: C21H21ClN4O5S MolecularWeight: 476.93324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN4O5S/c1-3-9-25-20(28)15-7-5-13(22)10-17(15)24-21(25)32-12-19(27)23-16-8-6-14(31-4-2)11-18(16)26(29)30/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,23,27)