[4-[(2-pyridin-1-ium-4-ylquinolin-4-yl)carbonylamino]phenyl]sulfonyl-(1,3-thiazol-2-yl)azanide

Systemtic Name: [4-[(2-pyridin-1-ium-4-ylquinolin-4-yl)carbonylamino]phenyl]sulfonyl-(1,3-thiazol-2-yl)azanide Openeye Name: [4-[(2-pyridin-1-ium-4-ylquinoline-4-carbonyl)amino]phenyl]sulfonyl-thiazol-2-yl-azanide CAS Name: [4-[[oxo-[2-(4-pyridin-1-iumyl)-4-quinolinyl]methyl]amino]phenyl]sulfonyl-(2-thiazolyl)azanide IUPAC Name: [4-[(2-pyridin-1-ium-4-ylquinoline-4-carbonyl)amino]phenyl]sulfonyl-(1,3-thiazol-2-yl)azanide Traditional Name: [4-[(2-pyridin-1-ium-4-ylquinoline-4-carbonyl)amino]phenyl]sulfonyl-thiazol-2-yl-azanide Formula: C24H17N5O3S2 MolecularWeight: 487.55348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=[NH+]C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)[N-]C5=NC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=[NH+]C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)[N-]C5=NC=CS5

InChI

InChI=1S/C24H17N5O3S2/c30-23(27-17-5-7-18(8-6-17)34(31,32)29-24-26-13-14-33-24)20-15-22(16-9-11-25-12-10-16)28-21-4-2-1-3-19(20)21/h1-15H,(H2,26,27,29,30)