sodium 5-(carbamothioylamino)benzene-1,3-disulfonic acid

Systemtic Name: sodium 5-(carbamothioylamino)benzene-1,3-disulfonic acid Openeye Name: sodium 5-(carbamothioylamino)benzene-1,3-disulfonic acid CAS Name: sodium 5-(carbamothioylamino)benzene-1,3-disulfonic acid IUPAC Name: sodium 5-(carbamothioylamino)benzene-1,3-disulfonic acid Traditional Name: sodium 5-thioureidobenzene-1,3-disulfonic acid Formula: C7H8N2NaO6S3+ MolecularWeight: 335.33299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)NC(=S)N.[Na+]

Isomeric SMILES

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)NC(=S)N.[Na+]

InChI

InChI=1S/C7H8N2O6S3.Na/c8-7(16)9-4-1-5(17(10,11)12)3-6(2-4)18(13,14)15;/h1-3H,(H3,8,9,16)(H,10,11,12)(H,13,14,15);/q;+1