disodium 2-[carbamothioyl(sulfonatomethyl)amino]ethanesulfonate

Systemtic Name: disodium 2-[carbamothioyl(sulfonatomethyl)amino]ethanesulfonate Openeye Name: disodium 2-[carbamothioyl(sulfonatomethyl)amino]ethanesulfonate CAS Name: disodium 2-[carbamothioyl(sulfonatomethyl)amino]ethanesulfonate IUPAC Name: disodium 2-[carbamothioyl(sulfonatomethyl)amino]ethanesulfonate Traditional Name: disodium 2-[sulfonatomethyl(thiocarbamoyl)amino]ethanesulfonate Formula: C4H8N2Na2O6S3 MolecularWeight: 322.29066

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)[O-])N(CS(=O)(=O)[O-])C(=S)N.[Na+].[Na+]

Isomeric SMILES

C(CS(=O)(=O)[O-])N(CS(=O)(=O)[O-])C(=S)N.[Na+].[Na+]

InChI

InChI=1S/C4H10N2O6S3.2Na/c5-4(13)6(3-15(10,11)12)1-2-14(7,8)9;;/h1-3H2,(H2,5,13)(H,7,8,9)(H,10,11,12);;/q;2*+1/p-2