2-(5-chloranylthiophen-2-yl)-N-(4-methyl-3-nitro-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-(4-methyl-3-nitro-phenyl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-(4-methyl-3-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-(4-methyl-3-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-(4-methyl-3-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-(4-methyl-3-nitro-phenyl)cinchoninamide Formula: C21H14ClN3O3S MolecularWeight: 423.87216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O3S/c1-12-6-7-13(10-18(12)25(27)28)23-21(26)15-11-17(19-8-9-20(22)29-19)24-16-5-3-2-4-14(15)16/h2-11H,1H3,(H,23,26)