3-(3-sulfopropylcarbamothioylamino)propane-1-sulfonic acid

Systemtic Name: 3-(3-sulfopropylcarbamothioylamino)propane-1-sulfonic acid Openeye Name: 3-(3-sulfopropylcarbamothioylamino)propane-1-sulfonic acid CAS Name: 3-[[sulfanylidene-(3-sulfopropylamino)methyl]amino]-1-propanesulfonic acid IUPAC Name: 3-(3-sulfopropylcarbamothioylamino)propane-1-sulfonic acid Traditional Name: 3-(3-sulfopropylthiocarbamoylamino)propane-1-sulfonic acid Formula: C7H16N2O6S3 MolecularWeight: 320.40674

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(=S)NCCCS(=O)(=O)O)CS(=O)(=O)O

Isomeric SMILES

C(CNC(=S)NCCCS(=O)(=O)O)CS(=O)(=O)O

InChI

InChI=1S/C7H16N2O6S3/c10-17(11,12)5-1-3-8-7(16)9-4-2-6-18(13,14)15/h1-6H2,(H2,8,9,16)(H,10,11,12)(H,13,14,15)