4-[[methyl(pyridin-3-ylmethyl)amino]methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[[methyl(pyridin-3-ylmethyl)amino]methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[[methyl(3-pyridylmethyl)amino]methyl]thiazole-2-carboxylic acid CAS Name: 4-[[methyl(3-pyridinylmethyl)amino]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[[methyl(pyridin-3-ylmethyl)amino]methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[methyl(3-pyridylmethyl)amino]methyl]thiazole-2-carboxylic acid Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=CC=C1)CC2=CSC(=N2)C(=O)O

Isomeric SMILES

CN(CC1=CN=CC=C1)CC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C12H13N3O2S/c1-15(6-9-3-2-4-13-5-9)7-10-8-18-11(14-10)12(16)17/h2-5,8H,6-7H2,1H3,(H,16,17)