(5-methyl-1,2-oxazol-3-yl)-[4-[(4-pyridin-1-ium-2-yl-1,3-thiazol-2-yl)amino]phenyl]sulfonyl-azanide

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)-[4-[(4-pyridin-1-ium-2-yl-1,3-thiazol-2-yl)amino]phenyl]sulfonyl-azanide Openeye Name: (5-methylisoxazol-3-yl)-[4-[(4-pyridin-1-ium-2-ylthiazol-2-yl)amino]phenyl]sulfonyl-azanide CAS Name: (5-methyl-3-isoxazolyl)-[4-[[4-(2-pyridin-1-iumyl)-2-thiazolyl]amino]phenyl]sulfonylazanide IUPAC Name: (5-methyl-1,2-oxazol-3-yl)-[4-[(4-pyridin-1-ium-2-yl-1,3-thiazol-2-yl)amino]phenyl]sulfonylazanide Traditional Name: (5-methylisoxazol-3-yl)-[4-[(4-pyridin-1-ium-2-ylthiazol-2-yl)amino]phenyl]sulfonyl-azanide Formula: C18H15N5O3S2 MolecularWeight: 413.4734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C18H14N5O3S2/c1-12-10-17(22-26-12)23-28(24,25)14-7-5-13(6-8-14)20-18-21-16(11-27-18)15-4-2-3-9-19-15/h2-11H,1H3,(H-,20,21,22,23)/q-1/p+1