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

Systemtic Name: 3-[5-(furan-2-yl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid Openeye Name: 3-[5-(2-furyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]propanoic acid CAS Name: 3-[5-(2-furanyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid IUPAC Name: 3-[5-(furan-2-yl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]propanoic acid Traditional Name: 3-[5-(2-furyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]propionic acid Formula: C10H12N2O3S2 MolecularWeight: 272.34388

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1C2=CC=CO2)CCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1C2=CC=CO2)CCC(=O)O

InChI

InChI=1S/C10H12N2O3S2/c13-9(14)3-4-11-6-12(10(16)17-7-11)8-2-1-5-15-8/h1-2,5H,3-4,6-7H2,(H,13,14)