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

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-(2-thienyl)cinchoninamide Formula: C22H14ClN3OS2 MolecularWeight: 435.94906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)Cl

InChI

InChI=1S/C22H14ClN3OS2/c1-12-9-13(23)10-19-20(12)25-22(29-19)26-21(27)15-11-17(18-7-4-8-28-18)24-16-6-3-2-5-14(15)16/h2-11H,1H3,(H,25,26,27)