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

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(3-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(m-tolyl)quinoline-4-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(3-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(3-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(m-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=C6)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(=CC=C6)C

InChI

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