2-[2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanoylamino]terephthalic acid

Systemtic Name: 2-[2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanoylamino]terephthalic acid Openeye Name: 2-[[2-[2-(2-oxopyrrolidin-1-yl)thiazol-4-yl]acetyl]amino]terephthalic acid CAS Name: 2-[[1-oxo-2-[2-(2-oxo-1-pyrrolidinyl)-4-thiazolyl]ethyl]amino]terephthalic acid IUPAC Name: 2-[[2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetyl]amino]terephthalic acid Traditional Name: 2-[[2-[2-(2-ketopyrrolidino)thiazol-4-yl]acetyl]amino]terephthalic acid Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C17H15N3O6S/c21-13(7-10-8-27-17(18-10)20-5-1-2-14(20)22)19-12-6-9(15(23)24)3-4-11(12)16(25)26/h3-4,6,8H,1-2,5,7H2,(H,19,21)(H,23,24)(H,25,26)