5-azido-2-[(2Z)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzenesulfonic acid

Systemtic Name: 5-azido-2-[(2Z)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzenesulfonic acid Openeye Name: 5-azido-2-[(2Z)-2-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]benzenesulfonic acid CAS Name: 5-azido-2-[(2Z)-2-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 5-azido-2-[(2Z)-2-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 5-azido-2-[(N'Z)-N'-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]besylic acid Formula: C16H13N7O4S MolecularWeight: 399.38392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2)N=[N+]=[N-])S(=O)(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=N\NC2=C(C=C(C=C2)N=[N+]=[N-])S(=O)(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H13N7O4S/c1-10-15(16(24)23(21-10)12-5-3-2-4-6-12)20-19-13-8-7-11(18-22-17)9-14(13)28(25,26)27/h2-9,19H,1H3,(H,25,26,27)/b20-15-