1-[(5-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2-pyridyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-pyridinyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-methyl-2-pyridyl)-(4-methyl-2-thienyl)methyl]proline Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC(=CS2)C)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC(=CS2)C)N3CCCC3C(=O)O

InChI

InChI=1S/C17H20N2O2S/c1-11-5-6-13(18-9-11)16(15-8-12(2)10-22-15)19-7-3-4-14(19)17(20)21/h5-6,8-10,14,16H,3-4,7H2,1-2H3,(H,20,21)