6-[5-(2-carboxyethyl)-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid

Systemtic Name: 6-[5-(2-carboxyethyl)-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Openeye Name: 6-[5-(2-carboxyethyl)-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid CAS Name: 6-[5-(2-carboxyethyl)-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid IUPAC Name: 6-[5-(2-carboxyethyl)-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Traditional Name: 6-[5-(2-carboxyethyl)-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid Formula: C12H20N2O4S2 MolecularWeight: 320.4282

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CCCCCC(=O)O)CCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1CCCCCC(=O)O)CCC(=O)O

InChI

InChI=1S/C12H20N2O4S2/c15-10(16)4-2-1-3-6-14-8-13(7-5-11(17)18)9-20-12(14)19/h1-9H2,(H,15,16)(H,17,18)