sodium 1-(furan-2-ylcarbonyl)-4-(3-sulfonatosulfanylpropanoyl)piperazine

Systemtic Name: sodium 1-(furan-2-ylcarbonyl)-4-(3-sulfonatosulfanylpropanoyl)piperazine Openeye Name: sodium 1-(furan-2-carbonyl)-4-(3-sulfonatosulfanylpropanoyl)piperazine CAS Name: sodium 1-[2-furanyl(oxo)methyl]-4-[1-oxo-3-(sulfonatothio)propyl]piperazine IUPAC Name: sodium 1-(furan-2-carbonyl)-4-(3-sulfonatosulfanylpropanoyl)piperazine Traditional Name: sodium 1-(2-furoyl)-4-[3-(sulfonatothio)propanoyl]piperazine Formula: C12H15N2NaO6S2 MolecularWeight: 370.37707

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCSS(=O)(=O)[O-])C(=O)C2=CC=CO2.[Na+]

Isomeric SMILES

C1CN(CCN1C(=O)CCSS(=O)(=O)[O-])C(=O)C2=CC=CO2.[Na+]

InChI

InChI=1S/C12H16N2O6S2.Na/c15-11(3-9-21-22(17,18)19)13-4-6-14(7-5-13)12(16)10-2-1-8-20-10;/h1-2,8H,3-7,9H2,(H,17,18,19);/q;+1/p-1