N-(1,3-benzothiazol-2-yl)-N-butyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-(2-thienyl)cinchoninamide Formula: C25H21N3OS2 MolecularWeight: 443.58374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

CCCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C25H21N3OS2/c1-2-3-14-28(25-27-20-11-6-7-12-23(20)31-25)24(29)18-16-21(22-13-8-15-30-22)26-19-10-5-4-9-17(18)19/h4-13,15-16H,2-3,14H2,1H3