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

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]cinchoninamide Formula: C32H25N3OS MolecularWeight: 499.6254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=C(C=C6)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=C(C=C6)C)C

InChI

InChI=1S/C32H25N3OS/c1-19-8-15-28-30(16-19)37-32(35-28)22-11-13-24(14-12-22)33-31(36)26-18-29(23-10-9-20(2)21(3)17-23)34-27-7-5-4-6-25(26)27/h4-18H,1-3H3,(H,33,36)