2-(5-chloranylthiophen-2-yl)-N-(2-methoxy-5-nitro-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-(2-methoxy-5-nitro-phenyl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-(2-methoxy-5-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-(2-methoxy-5-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-(2-methoxy-5-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-(2-methoxy-5-nitro-phenyl)cinchoninamide Formula: C21H14ClN3O4S MolecularWeight: 439.87156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H14ClN3O4S/c1-29-18-7-6-12(25(27)28)10-16(18)24-21(26)14-11-17(19-8-9-20(22)30-19)23-15-5-3-2-4-13(14)15/h2-11H,1H3,(H,24,26)