N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(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=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Cl

InChI

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