2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)cinchoninamide Formula: C26H21N3OS MolecularWeight: 423.52944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C

InChI

InChI=1S/C26H21N3OS/c1-15-8-11-22-24(12-15)31-26(28-22)29-25(30)20-14-23(18-10-9-16(2)17(3)13-18)27-21-7-5-4-6-19(20)21/h4-14H,1-3H3,(H,28,29,30)