N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-thienyl)quinoline-4-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-thienyl)cinchoninamide Formula: C22H14ClN3OS2 MolecularWeight: 435.94906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC5=C(S4)C=C(C=C5)Cl

InChI

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