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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CN(C(=S)SC1)C(=O)C2=CC=CO2

Isomeric SMILES

C[C@@H](C(=O)O)N1CN(C(=S)SC1)C(=O)C2=CC=CO2

InChI

InChI=1S/C11H12N2O4S2/c1-7(10(15)16)12-5-13(11(18)19-6-12)9(14)8-3-2-4-17-8/h2-4,7H,5-6H2,1H3,(H,15,16)/t7-/m0/s1