6-chloranyl-2-(2,5-dimethylthiophen-3-yl)-N-(2-nitrophenyl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-2-(2,5-dimethylthiophen-3-yl)-N-(2-nitrophenyl)quinoline-4-carboxamide Openeye Name: 6-chloro-2-(2,5-dimethyl-3-thienyl)-N-(2-nitrophenyl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(2,5-dimethyl-3-thiophenyl)-N-(2-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-2-(2,5-dimethylthiophen-3-yl)-N-(2-nitrophenyl)quinoline-4-carboxamide Traditional Name: 6-chloro-2-(2,5-dimethyl-3-thienyl)-N-(2-nitrophenyl)cinchoninamide Formula: C22H16ClN3O3S MolecularWeight: 437.89874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H16ClN3O3S/c1-12-9-15(13(2)30-12)20-11-17(16-10-14(23)7-8-18(16)24-20)22(27)25-19-5-3-4-6-21(19)26(28)29/h3-11H,1-2H3,(H,25,27)