2-(1,5-dimethylpyrazol-4-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinoline-4-carboxamide CAS Name: 2-(1,5-dimethyl-4-pyrazolyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[4-(4-methylpiperazino)phenyl]cinchoninamide Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C26H28N6O/c1-18-23(17-27-31(18)3)25-16-22(21-6-4-5-7-24(21)29-25)26(33)28-19-8-10-20(11-9-19)32-14-12-30(2)13-15-32/h4-11,16-17H,12-15H2,1-3H3,(H,28,33)