2-[2-[(E)-3-chloranylprop-2-enyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[(E)-3-chloranylprop-2-enyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-[(E)-3-chloroallyl]sulfanyl-4-methyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[[(E)-3-chloroprop-2-enyl]thio]-4-methyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-[(E)-3-chloroprop-2-enyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[[(E)-3-chloroallyl]thio]-4-methyl-thiazol-5-yl]acetic acid Formula: C9H10ClNO2S2 MolecularWeight: 263.7642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC=CCl)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SC/C=C/Cl)CC(=O)O

InChI

InChI=1S/C9H10ClNO2S2/c1-6-7(5-8(12)13)15-9(11-6)14-4-2-3-10/h2-3H,4-5H2,1H3,(H,12,13)/b3-2+