(2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-sulfanylidene-1,3-thiazol-3-yl]hexanoic acid

Systemtic Name: (2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-sulfanylidene-1,3-thiazol-3-yl]hexanoic acid Openeye Name: (2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-thioxo-thiazol-3-yl]hexanoic acid CAS Name: (2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-sulfanylidene-3-thiazolyl]hexanoic acid IUPAC Name: (2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-sulfanylidene-1,3-thiazol-3-yl]hexanoic acid Traditional Name: (2S)-2-acetamido-6-[5-(2-hydroxyethyl)-4-methyl-2-thioxo-4-thiazolin-3-yl]hexanoic acid Formula: C14H22N2O4S2 MolecularWeight: 346.46548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=S)N1CCCCC(C(=O)O)NC(=O)C)CCO

Isomeric SMILES

CC1=C(SC(=S)N1CCCC[C@@H](C(=O)O)NC(=O)C)CCO

InChI

InChI=1S/C14H22N2O4S2/c1-9-12(6-8-17)22-14(21)16(9)7-4-3-5-11(13(19)20)15-10(2)18/h11,17H,3-8H2,1-2H3,(H,15,18)(H,19,20)/t11-/m0/s1