N-(2,5-diethoxy-4-nitro-phenyl)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-[(6-methoxy-2-methyl-4-quinolyl)sulfanyl]acetamide CAS Name: N-(2,5-diethoxy-4-nitrophenyl)-2-[(6-methoxy-2-methyl-4-quinolinyl)thio]acetamide IUPAC Name: N-(2,5-diethoxy-4-nitrophenyl)-2-(6-methoxy-2-methylquinolin-4-yl)sulfanylacetamide Traditional Name: N-(2,5-diethoxy-4-nitro-phenyl)-2-[(6-methoxy-2-methyl-4-quinolyl)thio]acetamide Formula: C23H25N3O6S MolecularWeight: 471.5261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)CSC2=CC(=NC3=C2C=C(C=C3)OC)C)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)CSC2=CC(=NC3=C2C=C(C=C3)OC)C)OCC)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O6S/c1-5-31-20-12-19(26(28)29)21(32-6-2)11-18(20)25-23(27)13-33-22-9-14(3)24-17-8-7-15(30-4)10-16(17)22/h7-12H,5-6,13H2,1-4H3,(H,25,27)