N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[4-(4-methylpiperazino)sulfonylphenyl]-2-(2-pyridyl)cinchoninamide Formula: C26H25N5O3S MolecularWeight: 487.5734

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C26H25N5O3S/c1-30-14-16-31(17-15-30)35(33,34)20-11-9-19(10-12-20)28-26(32)22-18-25(24-8-4-5-13-27-24)29-23-7-3-2-6-21(22)23/h2-13,18H,14-17H2,1H3,(H,28,32)