5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]pentanoic acid

Systemtic Name: 5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]pentanoic acid Openeye Name: 5-(4-methylthiazol-2-yl)sulfanylpentanoic acid CAS Name: 5-[(4-methyl-2-thiazolyl)thio]pentanoic acid IUPAC Name: 5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]pentanoic acid Traditional Name: 5-[(4-methylthiazol-2-yl)thio]valeric acid Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCCCCC(=O)O

Isomeric SMILES

CC1=CSC(=N1)SCCCCC(=O)O

InChI

InChI=1S/C9H13NO2S2/c1-7-6-14-9(10-7)13-5-3-2-4-8(11)12/h6H,2-5H2,1H3,(H,11,12)