2-[(3-ethanoyl-1,3-thiazolidin-4-yl)carbonylamino]-3-[5-(phenylsulfonyloxy)pyridin-2-yl]propanoic acid

Systemtic Name: 2-[(3-ethanoyl-1,3-thiazolidin-4-yl)carbonylamino]-3-[5-(phenylsulfonyloxy)pyridin-2-yl]propanoic acid Openeye Name: 2-[(3-acetylthiazolidine-4-carbonyl)amino]-3-[5-(benzenesulfonyloxy)-2-pyridyl]propanoic acid CAS Name: 2-[[(3-acetyl-4-thiazolidinyl)-oxomethyl]amino]-3-[5-(benzenesulfonyloxy)-2-pyridinyl]propanoic acid IUPAC Name: 2-[(3-acetyl-1,3-thiazolidine-4-carbonyl)amino]-3-[5-(benzenesulfonyloxy)pyridin-2-yl]propanoic acid Traditional Name: 2-[(3-acetylthiazolidine-4-carbonyl)amino]-3-(5-besyloxy-2-pyridyl)propionic acid Formula: C20H21N3O7S2 MolecularWeight: 479.52664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CSCC1C(=O)NC(CC2=NC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)N1CSCC1C(=O)NC(CC2=NC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H21N3O7S2/c1-13(24)23-12-31-11-18(23)19(25)22-17(20(26)27)9-14-7-8-15(10-21-14)30-32(28,29)16-5-3-2-4-6-16/h2-8,10,17-18H,9,11-12H2,1H3,(H,22,25)(H,26,27)