4-butyl-2-chloranyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-butyl-2-chloranyl-1,3-thiazole-5-carboxylic acid Openeye Name: 4-butyl-2-chloro-thiazole-5-carboxylic acid CAS Name: 4-butyl-2-chloro-5-thiazolecarboxylic acid IUPAC Name: 4-butyl-2-chloro-1,3-thiazole-5-carboxylic acid Traditional Name: 4-butyl-2-chloro-thiazole-5-carboxylic acid Formula: C8H10ClNO2S MolecularWeight: 219.6885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC(=N1)Cl)C(=O)O

Isomeric SMILES

CCCCC1=C(SC(=N1)Cl)C(=O)O

InChI

InChI=1S/C8H10ClNO2S/c1-2-3-4-5-6(7(11)12)13-8(9)10-5/h2-4H2,1H3,(H,11,12)