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

Systemtic Name: 2-[2-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[5-(furan-2-carbonyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]acetyl]amino]acetic acid CAS Name: 2-[[2-[5-[2-furanyl(oxo)methyl]-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[5-(furan-2-carbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]acetyl]amino]acetic acid Traditional Name: 2-[[2-[5-(2-furoyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]acetyl]amino]acetic acid Formula: C12H13N3O5S2 MolecularWeight: 343.37872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O5S2/c16-9(13-4-10(17)18)5-14-6-15(12(21)22-7-14)11(19)8-2-1-3-20-8/h1-3H,4-7H2,(H,13,16)(H,17,18)