6-bromanyl-8-methyl-N-phenyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-8-methyl-N-phenyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-8-methyl-N-phenyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: 6-bromo-8-methyl-N-phenyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-8-methyl-N-phenyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: 6-bromo-8-methyl-N-phenyl-2-(2-thienyl)cinchoninamide Formula: C21H15BrN2OS MolecularWeight: 423.3256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H15BrN2OS/c1-13-10-14(22)11-16-17(21(25)23-15-6-3-2-4-7-15)12-18(24-20(13)16)19-8-5-9-26-19/h2-12H,1H3,(H,23,25)