N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(3-methoxyphenyl)cinchoninamide Formula: C24H16BrN3O2S MolecularWeight: 490.37174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

InChI

InChI=1S/C24H16BrN3O2S/c1-30-16-6-4-5-14(11-16)21-13-18(17-7-2-3-8-19(17)26-21)23(29)28-24-27-20-10-9-15(25)12-22(20)31-24/h2-13H,1H3,(H,27,28,29)