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

Systemtic Name: 3-[[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoic acid Openeye Name: 3-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoic acid CAS Name: 3-[oxo-[[(3S,5S)-5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]methylamino]methyl]benzoic acid IUPAC Name: 3-[[(3S,5S)-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoic acid Traditional Name: 3-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoic acid Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCN1C(=O)C2CC(CN2)CNC(=O)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4S/c21-15(12-2-1-3-13(7-12)17(23)24)19-9-11-6-14(18-8-11)16(22)20-4-5-25-10-20/h1-3,7,11,14,18H,4-6,8-10H2,(H,19,21)(H,23,24)/t11-,14-/m0/s1