2,6-dimethoxy-4-[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]ethanoylhydrazinylidene]methyl]phenolate

Systemtic Name: 2,6-dimethoxy-4-[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]ethanoylhydrazinylidene]methyl]phenolate Openeye Name: 2,6-dimethoxy-4-[[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]acetyl]hydrazono]methyl]phenolate CAS Name: 2,6-dimethoxy-4-[[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)thio]-1-oxoethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 2,6-dimethoxy-4-[[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenolate Traditional Name: 2,6-dimethoxy-4-[[[2-[(4-methyl-1H-1,2,4-triazol-4-ium-5-yl)thio]acetyl]hydrazono]methyl]phenolate Formula: C14H17N5O4S MolecularWeight: 351.38088

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NN=C1)SCC(=O)NN=CC2=CC(=C(C(=C2)OC)[O-])OC

Isomeric SMILES

C[N+]1=C(NN=C1)SCC(=O)NN=CC2=CC(=C(C(=C2)OC)[O-])OC

InChI

InChI=1S/C14H17N5O4S/c1-19-8-16-18-14(19)24-7-12(20)17-15-6-9-4-10(22-2)13(21)11(5-9)23-3/h4-6,8H,7H2,1-3H3,(H2,15,17,20,21)