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

Systemtic Name: 6-[5-[2-(carboxymethylamino)-2-oxidanylidene-ethyl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Openeye Name: 6-[5-[2-(carboxymethylamino)-2-oxo-ethyl]-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid CAS Name: 6-[5-[2-(carboxymethylamino)-2-oxoethyl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid IUPAC Name: 6-[5-[2-(carboxymethylamino)-2-oxoethyl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Traditional Name: 6-[5-[2-(carboxymethylamino)-2-keto-ethyl]-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid Formula: C13H21N3O5S2 MolecularWeight: 363.45294

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CCCCCC(=O)O)CC(=O)NCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1CCCCCC(=O)O)CC(=O)NCC(=O)O

InChI

InChI=1S/C13H21N3O5S2/c17-10(14-6-12(20)21)7-15-8-16(13(22)23-9-15)5-3-1-2-4-11(18)19/h1-9H2,(H,14,17)(H,18,19)(H,20,21)