3-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid

Systemtic Name: 3-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid Openeye Name: 3-[5-(furan-2-carbonyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]propanoic acid CAS Name: 3-[5-[2-furanyl(oxo)methyl]-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid IUPAC Name: 3-[5-(furan-2-carbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid Traditional Name: 3-[5-(2-furoyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]propionic acid Formula: C11H12N2O4S2 MolecularWeight: 300.35398

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1C(=O)C2=CC=CO2)CCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1C(=O)C2=CC=CO2)CCC(=O)O

InChI

InChI=1S/C11H12N2O4S2/c14-9(15)3-4-12-6-13(11(18)19-7-12)10(16)8-2-1-5-17-8/h1-2,5H,3-4,6-7H2,(H,14,15)