N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-6,8-dimethyl-2-(3-pyridyl)cinchoninamide Formula: C25H20N4O2S MolecularWeight: 440.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC)C

InChI

InChI=1S/C25H20N4O2S/c1-14-9-15(2)23-18(10-14)19(12-21(27-23)16-5-4-8-26-13-16)24(30)29-25-28-20-7-6-17(31-3)11-22(20)32-25/h4-13H,1-3H3,(H,28,29,30)