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

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]acetamide Formula: C22H26BrN7O3 MolecularWeight: 516.39094

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CN4C(=C(C(=N4)[N+](=O)[O-])Br)C)C(=C2)C

Isomeric SMILES

CCN1CCN(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/C22H26BrN7O3/c1-4-27-7-9-28(10-8-27)19-11-14(2)17-12-16(5-6-18(17)25-19)24-20(31)13-29-15(3)21(23)22(26-29)30(32)33/h5-6,11-12H,4,7-10,13H2,1-3H3,(H,24,31)