6-chloranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(3-pyridyl)cinchoninamide Formula: C26H25ClN5O3S+ MolecularWeight: 523.0264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CN=CC=C5

InChI

InChI=1S/C26H24ClN5O3S/c1-31-11-13-32(14-12-31)36(34,35)21-7-5-20(6-8-21)29-26(33)23-16-25(18-3-2-10-28-17-18)30-24-9-4-19(27)15-22(23)24/h2-10,15-17H,11-14H2,1H3,(H,29,33)/p+1