N-(1,3-benzothiazol-2-yl)-2-(5-chloranylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(5-chloranylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(5-chloro-2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(5-chloro-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(5-chlorothiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(5-chloro-2-thienyl)cinchoninamide Formula: C21H12ClN3OS2 MolecularWeight: 421.92248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H12ClN3OS2/c22-19-10-9-18(27-19)16-11-13(12-5-1-2-6-14(12)23-16)20(26)25-21-24-15-7-3-4-8-17(15)28-21/h1-11H,(H,24,25,26)