4-oxidanyl-5-oxidanylidene-3-pyrrolidin-1-ylcarbothioylsulfanyl-2-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 4-oxidanyl-5-oxidanylidene-3-pyrrolidin-1-ylcarbothioylsulfanyl-2-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 4-hydroxy-5-oxo-3-(pyrrolidine-1-carbothioylsulfanyl)-2-(pyrrolidine-1-carbothioylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 4-hydroxy-5-oxo-3-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]-2-[[[1-pyrrolidinyl(sulfanylidene)methyl]thio]methyl]-2-furancarboxylic acid IUPAC Name: 4-hydroxy-5-oxo-3-(pyrrolidine-1-carbothioylsulfanyl)-2-(pyrrolidine-1-carbothioylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 4-hydroxy-5-keto-3-(pyrrolidine-1-carbothioylthio)-2-[(pyrrolidine-1-carbothioylthio)methyl]-2-furoic acid Formula: C16H20N2O5S4 MolecularWeight: 448.6004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC2(C(=C(C(=O)O2)O)SC(=S)N3CCCC3)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=S)SCC2(C(=C(C(=O)O2)O)SC(=S)N3CCCC3)C(=O)O

InChI

InChI=1S/C16H20N2O5S4/c19-10-11(27-15(25)18-7-3-4-8-18)16(13(21)22,23-12(10)20)9-26-14(24)17-5-1-2-6-17/h19H,1-9H2,(H,21,22)