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1-[isoquinolin-6-yl(thiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

1-[isoquinolin-6-yl(thiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name:1-[isoquinolin-6-yl(thiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[6-isoquinolyl(2-thienyl)methyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[6-isoquinolinyl(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[isoquinolin-6-yl(thiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[6-isoquinolyl(2-thienyl)methyl]proline
Formula: C19H18N2O2S
MolecularWeight: 338.42342
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CS4)C(=O)O


Isomeric SMILES

C1CC(N(C1)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CS4)C(=O)O


InChI

InChI=1S/C19H18N2O2S/c22-19(23)16-3-1-9-21(16)18(17-4-2-10-24-17)14-5-6-15-12-20-8-7-13(15)11-14/h2,4-8,10-12,16,18H,1,3,9H2,(H,22,23)


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