2-[(2R)-1-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]-1,3-thiazole

Systemtic Name: 2-[(2R)-1-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]-1,3-thiazole Openeye Name: 2-[(2R)-1-[[5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]thiazole CAS Name: 2-[(2R)-1-[[5-(2-benzofuranyl)-1H-pyrazol-4-yl]methyl]-2-pyrrolidin-1-iumyl]thiazole IUPAC Name: 2-[(2R)-1-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]-1,3-thiazole Traditional Name: 2-[(2R)-1-[[5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]thiazole Formula: C19H19N4OS+ MolecularWeight: 351.44536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=C(NN=C2)C3=CC4=CC=CC=C4O3)C5=NC=CS5

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=C(NN=C2)C3=CC4=CC=CC=C4O3)C5=NC=CS5

InChI

InChI=1S/C19H18N4OS/c1-2-6-16-13(4-1)10-17(24-16)18-14(11-21-22-18)12-23-8-3-5-15(23)19-20-7-9-25-19/h1-2,4,6-7,9-11,15H,3,5,8,12H2,(H,21,22)/p+1/t15-/m1/s1