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

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(o-tolyl)quinoline-4-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(o-tolyl)cinchoninamide Formula: C31H23N3OS MolecularWeight: 485.59882

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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=CC=C6C

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=CC=C6C

InChI

InChI=1S/C31H23N3OS/c1-19-11-16-27-29(17-19)36-31(34-27)21-12-14-22(15-13-21)32-30(35)25-18-28(23-8-4-3-7-20(23)2)33-26-10-6-5-9-24(25)26/h3-18H,1-2H3,(H,32,35)