N-(2,5-diethoxy-4-nitro-phenyl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-[(3-ethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2,5-diethoxy-4-nitrophenyl)-2-[(3-ethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2,5-diethoxy-4-nitrophenyl)-2-(3-ethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-[(3-ethyl-2-quinolyl)thio]acetamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3OCC)[N+](=O)[O-])OCC

Isomeric SMILES

CCC1=CC2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3OCC)[N+](=O)[O-])OCC

InChI

InChI=1S/C23H25N3O5S/c1-4-15-11-16-9-7-8-10-17(16)25-23(15)32-14-22(27)24-18-12-21(31-6-3)19(26(28)29)13-20(18)30-5-2/h7-13H,4-6,14H2,1-3H3,(H,24,27)