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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C=C6)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C=C6)C)C

InChI

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