N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-isopropylphenyl)-N-(4-methyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-p-cumenyl-cinchoninamide Formula: C27H23N3OS MolecularWeight: 437.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C27H23N3OS/c1-16(2)18-11-13-19(14-12-18)23-15-21(20-8-4-5-9-22(20)28-23)26(31)30-27-29-25-17(3)7-6-10-24(25)32-27/h4-16H,1-3H3,(H,29,30,31)