8-methyl-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: 8-methyl-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: 8-methyl-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-2-phenyl-quinoline-4-carboxamide CAS Name: 8-methyl-N-[2-[(2-methyl-1-oxopropyl)amino]-1,3-benzothiazol-5-yl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 8-methyl-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)-1,3-benzothiazol-5-yl]-8-methyl-2-phenyl-cinchoninamide Formula: C28H24N4O2S MolecularWeight: 480.58076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)NC3=CC4=C(C=C3)SC(=N4)NC(=O)C(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)NC3=CC4=C(C=C3)SC(=N4)NC(=O)C(C)C)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O2S/c1-16(2)26(33)32-28-31-23-14-19(12-13-24(23)35-28)29-27(34)21-15-22(18-9-5-4-6-10-18)30-25-17(3)8-7-11-20(21)25/h4-16H,1-3H3,(H,29,34)(H,31,32,33)