4-[2-(3-azanyl-5-azanylidene-1-methylsulfonyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 4-[2-(3-azanyl-5-azanylidene-1-methylsulfonyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid Openeye Name: 4-[2-(3-amino-5-imino-1-methylsulfonyl-pyrazol-4-ylidene)hydrazino]benzoic acid CAS Name: 4-[2-(3-amino-5-imino-1-methylsulfonyl-4-pyrazolylidene)hydrazinyl]benzoic acid IUPAC Name: 4-[2-(3-amino-5-imino-1-methylsulfonylpyrazol-4-ylidene)hydrazinyl]benzoic acid Traditional Name: 4-[N'-(3-amino-5-imino-1-mesyl-2-pyrazolin-4-ylidene)hydrazino]benzoic acid Formula: C11H12N6O4S MolecularWeight: 324.31578

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=N)C(=NNC2=CC=C(C=C2)C(=O)O)C(=N1)N

Isomeric SMILES

CS(=O)(=O)N1C(=N)C(=NNC2=CC=C(C=C2)C(=O)O)C(=N1)N

InChI

InChI=1S/C11H12N6O4S/c1-22(20,21)17-10(13)8(9(12)16-17)15-14-7-4-2-6(3-5-7)11(18)19/h2-5,13-14H,1H3,(H2,12,16)(H,18,19)