4-(3,4-dimethylpyridin-1-ium-1-yl)-5-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]-1,3-thiazol-2-olate

Systemtic Name: 4-(3,4-dimethylpyridin-1-ium-1-yl)-5-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]-1,3-thiazol-2-olate Openeye Name: 4-(3,4-dimethylpyridin-1-ium-1-yl)-5-[(E)-(pyridine-3-carbonylhydrazono)methyl]thiazol-2-olate CAS Name: 4-(3,4-dimethyl-1-pyridin-1-iumyl)-5-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]-2-thiazololate IUPAC Name: 4-(3,4-dimethylpyridin-1-ium-1-yl)-5-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]-1,3-thiazol-2-olate Traditional Name: 4-(3,4-dimethylpyridin-1-ium-1-yl)-5-[(E)-(nicotinoylhydrazono)methyl]thiazol-2-olate Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[N+](C=C1)C2=C(SC(=N2)[O-])C=NNC(=O)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=[N+](C=C1)C2=C(SC(=N2)[O-])/C=N/NC(=O)C3=CN=CC=C3)C

InChI

InChI=1S/C17H15N5O2S/c1-11-5-7-22(10-12(11)2)15-14(25-17(24)20-15)9-19-21-16(23)13-4-3-6-18-8-13/h3-10H,1-2H3,(H-,19,20,21,23,24)