N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-2-(4-bromophenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-2-(4-bromophenyl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(3-carbamoyl-4,5-dimethyl-2-thienyl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(3-carbamoyl-4,5-dimethyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(3-carbamoyl-4,5-dimethyl-2-thienyl)cinchoninamide Formula: C23H18BrN3O2S MolecularWeight: 480.37692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H18BrN3O2S/c1-12-13(2)30-23(20(12)21(25)28)27-22(29)17-11-19(14-7-9-15(24)10-8-14)26-18-6-4-3-5-16(17)18/h3-11H,1-2H3,(H2,25,28)(H,27,29)