5-bromanyl-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]nicotinamide Formula: C22H24BrN5O MolecularWeight: 454.36286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C4=CC(=CN=C4)Br)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C4=CC(=CN=C4)Br)C(=C2)C

InChI

InChI=1S/C22H24BrN5O/c1-3-27-6-8-28(9-7-27)21-10-15(2)19-12-18(4-5-20(19)26-21)25-22(29)16-11-17(23)14-24-13-16/h4-5,10-14H,3,6-9H2,1-2H3,(H,25,29)