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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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