N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(5-nitroquinolin-8-yl)oxy-ethanamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(5-nitroquinolin-8-yl)oxy-ethanamide Openeye Name: 2-[(5-nitro-8-quinolyl)oxy]-N-[4-(p-tolyl)thiazol-2-yl]acetamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-2-[(5-nitro-8-quinolinyl)oxy]acetamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(5-nitroquinolin-8-yl)oxyacetamide Traditional Name: 2-[(5-nitro-8-quinolyl)oxy]-N-[4-(p-tolyl)thiazol-2-yl]acetamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

InChI

InChI=1S/C21H16N4O4S/c1-13-4-6-14(7-5-13)16-12-30-21(23-16)24-19(26)11-29-18-9-8-17(25(27)28)15-3-2-10-22-20(15)18/h2-10,12H,11H2,1H3,(H,23,24,26)