2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-methyl-2-(4-methyl-1-piperidyl)-6-quinolyl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[4-methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-methyl-2-(4-methylpiperidino)-6-quinolyl]acetamide Formula: C22H25BrN6O3 MolecularWeight: 501.3763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CN4C(=C(C(=N4)[N+](=O)[O-])Br)C)C(=C2)C

Isomeric SMILES

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CN4C(=C(C(=N4)[N+](=O)[O-])Br)C)C(=C2)C

InChI

InChI=1S/C22H25BrN6O3/c1-13-6-8-27(9-7-13)19-10-14(2)17-11-16(4-5-18(17)25-19)24-20(30)12-28-15(3)21(23)22(26-28)29(31)32/h4-5,10-11,13H,6-9,12H2,1-3H3,(H,24,30)