2-[[2-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]sulfonylmethyl]benzoic acid

Systemtic Name: 2-[[2-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]sulfonylmethyl]benzoic acid Openeye Name: 2-[[2-[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]pyrrolidin-1-yl]sulfonylmethyl]benzoic acid CAS Name: 2-[[2-[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]-1-pyrrolidinyl]sulfonylmethyl]benzoic acid IUPAC Name: 2-[[2-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]sulfonylmethyl]benzoic acid Traditional Name: 2-[[2-[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]pyrrolidino]sulfonylmethyl]benzoic acid Formula: C19H18N4O5S MolecularWeight: 414.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2C(=O)O)C3=NN=C(O3)C4=CN=CC=C4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2C(=O)O)C3=NN=C(O3)C4=CN=CC=C4

InChI

InChI=1S/C19H18N4O5S/c24-19(25)15-7-2-1-5-14(15)12-29(26,27)23-10-4-8-16(23)18-22-21-17(28-18)13-6-3-9-20-11-13/h1-3,5-7,9,11,16H,4,8,10,12H2,(H,24,25)