2-acetamido-5-(3-diazanyl-6-oxidanylidene-pyridazin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 2-acetamido-5-(3-diazanyl-6-oxidanylidene-pyridazin-1-yl)sulfonyl-benzoic acid Openeye Name: 2-acetamido-5-(3-hydrazino-6-oxo-pyridazin-1-yl)sulfonyl-benzoic acid CAS Name: 2-acetamido-5-[(3-hydrazinyl-6-oxo-1-pyridazinyl)sulfonyl]benzoic acid IUPAC Name: 2-acetamido-5-(3-hydrazinyl-6-oxopyridazin-1-yl)sulfonylbenzoic acid Traditional Name: 2-acetamido-5-(3-hydrazino-6-keto-pyridazin-1-yl)sulfonyl-benzoic acid Formula: C13H13N5O6S MolecularWeight: 367.33722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2C(=O)C=CC(=N2)NN)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2C(=O)C=CC(=N2)NN)C(=O)O

InChI

InChI=1S/C13H13N5O6S/c1-7(19)15-10-3-2-8(6-9(10)13(21)22)25(23,24)18-12(20)5-4-11(16-14)17-18/h2-6H,14H2,1H3,(H,15,19)(H,16,17)(H,21,22)