1-[1-benzothiophen-3-yl(pyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-benzothiophen-3-yl(pyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[benzothiophen-3-yl(4-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-benzothiophen-3-yl(pyridin-4-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-benzothiophen-3-yl(pyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[benzothiophen-3-yl(4-pyridyl)methyl]proline Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=NC=C2)C3=CSC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=NC=C2)C3=CSC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C19H18N2O2S/c22-19(23)16-5-3-11-21(16)18(13-7-9-20-10-8-13)15-12-24-17-6-2-1-4-14(15)17/h1-2,4,6-10,12,16,18H,3,5,11H2,(H,22,23)