1-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[2-(p-tolyl)thiazol-4-yl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[2-(4-methylphenyl)-4-thiazolyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[2-(p-tolyl)thiazol-4-yl]methyl]proline Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CN3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CN3CCCC3C(=O)O

InChI

InChI=1S/C16H18N2O2S/c1-11-4-6-12(7-5-11)15-17-13(10-21-15)9-18-8-2-3-14(18)16(19)20/h4-7,10,14H,2-3,8-9H2,1H3,(H,19,20)