6-[5-[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid

Systemtic Name: 6-[5-[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Openeye Name: 6-[5-[(1S)-1-carboxy-2-methyl-propyl]-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid CAS Name: 6-[5-[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid IUPAC Name: 6-[5-[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]-2-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Traditional Name: 6-[5-[(1S)-1-carboxy-2-methyl-propyl]-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid Formula: C14H24N2O4S2 MolecularWeight: 348.48136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1CN(C(=S)SC1)CCCCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2O4S2/c1-10(2)12(13(19)20)16-8-15(14(21)22-9-16)7-5-3-4-6-11(17)18/h10,12H,3-9H2,1-2H3,(H,17,18)(H,19,20)/t12-/m0/s1