4-[[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]methylsulfonylamino]benzoic acid

Systemtic Name: 4-[[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]methylsulfonylamino]benzoic acid Openeye Name: 4-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylsulfonylamino]benzoic acid CAS Name: 4-[[(3S,5S)-5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]methylsulfonylamino]benzoic acid IUPAC Name: 4-[[(3S,5S)-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylsulfonylamino]benzoic acid Traditional Name: 4-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylsulfonylamino]benzoic acid Formula: C16H21N3O5S2 MolecularWeight: 399.48504

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCN1C(=O)C2CC(CN2)CS(=O)(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CSCN1C(=O)[C@@H]2C[C@@H](CN2)CS(=O)(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H21N3O5S2/c20-15(19-5-6-25-10-19)14-7-11(8-17-14)9-26(23,24)18-13-3-1-12(2-4-13)16(21)22/h1-4,11,14,17-18H,5-10H2,(H,21,22)/t11-,14-/m0/s1