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

Systemtic Name: 2-(4-chlorophenyl)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]cinchoninamide Formula: C31H22ClN3OS MolecularWeight: 520.04388

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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=C(C(=NC5=CC=CC=C54)C6=CC=C(C=C6)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C31H22ClN3OS/c1-18-7-16-26-27(17-18)37-31(35-26)21-10-14-23(15-11-21)33-30(36)28-19(2)29(20-8-12-22(32)13-9-20)34-25-6-4-3-5-24(25)28/h3-17H,1-2H3,(H,33,36)