2-[4-methyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-methyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-methyl-2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-thiazol-5-yl]acetic acid CAS Name: 2-[4-methyl-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-methyl-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]-4-methyl-thiazol-5-yl]acetic acid Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC(C)C(=O)N2CCCC2)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SC(C)C(=O)N2CCCC2)CC(=O)O

InChI

InChI=1S/C13H18N2O3S2/c1-8-10(7-11(16)17)20-13(14-8)19-9(2)12(18)15-5-3-4-6-15/h9H,3-7H2,1-2H3,(H,16,17)