(2S)-4-azanyl-2-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-4-azanyl-2-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-4-amino-2-[5-(furan-2-carbonyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]-4-oxo-butanoic acid CAS Name: (2S)-4-amino-2-[5-[2-furanyl(oxo)methyl]-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-4-oxobutanoic acid IUPAC Name: (2S)-4-amino-2-[5-(furan-2-carbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-4-oxobutanoic acid Traditional Name: (2S)-4-amino-2-[5-(2-furoyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]-4-keto-butyric acid Formula: C12H13N3O5S2 MolecularWeight: 343.37872

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1C(=O)C2=CC=CO2)C(CC(=O)N)C(=O)O

Isomeric SMILES

C1N(CSC(=S)N1C(=O)C2=CC=CO2)[C@@H](CC(=O)N)C(=O)O

InChI

InChI=1S/C12H13N3O5S2/c13-9(16)4-7(11(18)19)14-5-15(12(21)22-6-14)10(17)8-2-1-3-20-8/h1-3,7H,4-6H2,(H2,13,16)(H,18,19)/t7-/m0/s1