4-(4-tert-butylphenyl)sulfanylpyridine-2-carboxylic acid

Systemtic Name: 4-(4-tert-butylphenyl)sulfanylpyridine-2-carboxylic acid Openeye Name: 4-(4-tert-butylphenyl)sulfanylpyridine-2-carboxylic acid CAS Name: 4-[(4-tert-butylphenyl)thio]-2-pyridinecarboxylic acid IUPAC Name: 4-(4-tert-butylphenyl)sulfanylpyridine-2-carboxylic acid Traditional Name: 4-[(4-tert-butylphenyl)thio]picolinic acid Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=NC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=NC=C2)C(=O)O

InChI

InChI=1S/C16H17NO2S/c1-16(2,3)11-4-6-12(7-5-11)20-13-8-9-17-14(10-13)15(18)19/h4-10H,1-3H3,(H,18,19)