1-[(5-ethylthiophen-2-yl)-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-(2-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]proline Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCC3C(=O)O

InChI

InChI=1S/C17H20N2O2S/c1-2-12-8-9-15(22-12)16(13-6-3-4-10-18-13)19-11-5-7-14(19)17(20)21/h3-4,6,8-10,14,16H,2,5,7,11H2,1H3,(H,20,21)