4-(3-pyridin-4-ylpropoxymethyl)-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-(3-pyridin-4-ylpropoxymethyl)-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[3-(4-pyridyl)propoxymethyl]thiazole-2-carboxylic acid CAS Name: 4-(3-pyridin-4-ylpropoxymethyl)-2-thiazolecarboxylic acid IUPAC Name: 4-(3-pyridin-4-ylpropoxymethyl)-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[3-(4-pyridyl)propoxymethyl]thiazole-2-carboxylic acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCCOCC2=CSC(=N2)C(=O)O

Isomeric SMILES

C1=CN=CC=C1CCCOCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C13H14N2O3S/c16-13(17)12-15-11(9-19-12)8-18-7-1-2-10-3-5-14-6-4-10/h3-6,9H,1-2,7-8H2,(H,16,17)