2-[bis(azanyl)methylideneamino]-2-(phenylsulfonyl)-2-sulfamoyl-ethanoic acid

Systemtic Name: 2-[bis(azanyl)methylideneamino]-2-(phenylsulfonyl)-2-sulfamoyl-ethanoic acid Openeye Name: 2-(benzenesulfonyl)-2-guanidino-2-sulfamoyl-acetic acid CAS Name: 2-(benzenesulfonyl)-2-(diaminomethylideneamino)-2-sulfamoylacetic acid IUPAC Name: 2-(benzenesulfonyl)-2-(diaminomethylideneamino)-2-sulfamoylacetic acid Traditional Name: 2-besyl-2-guanidino-2-sulfamoyl-acetic acid Formula: C9H12N4O6S2 MolecularWeight: 336.34478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(C(=O)O)(N=C(N)N)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(C(=O)O)(N=C(N)N)S(=O)(=O)N

InChI

InChI=1S/C9H12N4O6S2/c10-8(11)13-9(7(14)15,21(12,18)19)20(16,17)6-4-2-1-3-5-6/h1-5H,(H,14,15)(H4,10,11,13)(H2,12,18,19)