N-(2-chloranyl-4-nitro-phenyl)-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-chloro-4-nitro-phenyl)acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]-N-(2-chloro-4-nitro-phenyl)acetamide Formula: C19H14Cl2N4O4S MolecularWeight: 465.30986

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H14Cl2N4O4S/c1-2-7-24-18(27)13-8-11(20)3-5-15(13)23-19(24)30-10-17(26)22-16-6-4-12(25(28)29)9-14(16)21/h2-6,8-9H,1,7,10H2,(H,22,26)