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

Systemtic Name: 5-(carbamothioylamino)benzene-1,3-disulfonic acid Openeye Name: 5-(carbamothioylamino)benzene-1,3-disulfonic acid CAS Name: 5-(carbamothioylamino)benzene-1,3-disulfonic acid IUPAC Name: 5-(carbamothioylamino)benzene-1,3-disulfonic acid Traditional Name: 5-thioureidobenzene-1,3-disulfonic acid Formula: C7H8N2O6S3 MolecularWeight: 312.34322

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)NC(=S)N

Isomeric SMILES

C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)NC(=S)N

InChI

InChI=1S/C7H8N2O6S3/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)