N-[3-(2-ethoxyethyl)-4-fluoranyl-1,3-benzothiazol-2-ylidene]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[3-(2-ethoxyethyl)-4-fluoranyl-1,3-benzothiazol-2-ylidene]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-2-phenylquinoline-4-carboxamide Traditional Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-2-phenyl-cinchoninamide Formula: C27H22FN3O2S MolecularWeight: 471.545883

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC=C2SC1=NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)F

Isomeric SMILES

CCOCCN1C2=C(C=CC=C2SC1=NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)F

InChI

InChI=1S/C27H22FN3O2S/c1-2-33-16-15-31-25-21(28)12-8-14-24(25)34-27(31)30-26(32)20-17-23(18-9-4-3-5-10-18)29-22-13-7-6-11-19(20)22/h3-14,17H,2,15-16H2,1H3