6-bromanyl-N-(2,3-dimethylphenyl)-8-methyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(2,3-dimethylphenyl)-8-methyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-(2,3-dimethylphenyl)-8-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-(2,3-dimethylphenyl)-8-methyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(2,3-dimethylphenyl)-8-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-(2,3-dimethylphenyl)-8-methyl-2-(2-thienyl)cinchoninamide Formula: C23H19BrN2OS MolecularWeight: 451.37876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC(=NC3=C(C=C(C=C23)Br)C)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC(=NC3=C(C=C(C=C23)Br)C)C4=CC=CS4)C

InChI

InChI=1S/C23H19BrN2OS/c1-13-6-4-7-19(15(13)3)26-23(27)18-12-20(21-8-5-9-28-21)25-22-14(2)10-16(24)11-17(18)22/h4-12H,1-3H3,(H,26,27)