N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-quinoline-4-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-cinchoninamide Formula: C27H23FN4OS MolecularWeight: 470.561123

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H23FN4OS/c1-31(2)15-16-32(27-30-25-21(28)12-8-14-24(25)34-27)26(33)20-17-23(18-9-4-3-5-10-18)29-22-13-7-6-11-19(20)22/h3-14,17H,15-16H2,1-2H3