azanium 4-[(4E)-3-methyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrazol-1-yl]benzenesulfonic acid

Systemtic Name: azanium 4-[(4E)-3-methyl-5-oxidanylidene-4-(thiophen-2-ylmethylidene)pyrazol-1-yl]benzenesulfonic acid Openeye Name: ammonium 4-[(4E)-3-methyl-5-oxo-4-(2-thienylmethylene)pyrazol-1-yl]benzenesulfonic acid CAS Name: ammonium 4-[(4E)-3-methyl-5-oxo-4-(thiophen-2-ylmethylidene)-1-pyrazolyl]benzenesulfonic acid IUPAC Name: azanium 4-[(4E)-3-methyl-5-oxo-4-(thiophen-2-ylmethylidene)pyrazol-1-yl]benzenesulfonic acid Traditional Name: ammonium 4-[(4E)-5-keto-3-methyl-4-(2-thenylidene)-2-pyrazolin-1-yl]besylic acid Formula: C15H16N3O4S2+ MolecularWeight: 366.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=CS2)C3=CC=C(C=C3)S(=O)(=O)O.[NH4+]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=CS2)C3=CC=C(C=C3)S(=O)(=O)O.[NH4+]

InChI

InChI=1S/C15H12N2O4S2.H3N/c1-10-14(9-12-3-2-8-22-12)15(18)17(16-10)11-4-6-13(7-5-11)23(19,20)21;/h2-9H,1H3,(H,19,20,21);1H3/p+1/b14-9+;