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

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-chloranyl-2-nitro-phenyl)ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-chloro-2-nitro-phenyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(4-chloro-2-nitrophenyl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-chloro-2-nitrophenyl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(4-chloro-2-nitro-phenyl)acetamide Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O4S/c1-2-3-10-24-19(27)14-6-4-5-7-15(14)23-20(24)30-12-18(26)22-16-9-8-13(21)11-17(16)25(28)29/h4-9,11H,2-3,10,12H2,1H3,(H,22,26)