N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(2-thienyl)cinchoninamide Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C21H17N3OS2/c25-20(24-21-23-16-8-3-4-9-19(16)27-21)14-12-17(18-10-5-11-26-18)22-15-7-2-1-6-13(14)15/h1-2,5-7,10-12H,3-4,8-9H2,(H,23,24,25)