4-[4-(butylsulfonylmethyl)-2-sulfanylidene-1,3-thiazol-3-yl]butanoic acid

Systemtic Name: 4-[4-(butylsulfonylmethyl)-2-sulfanylidene-1,3-thiazol-3-yl]butanoic acid Openeye Name: 4-[4-(butylsulfonylmethyl)-2-thioxo-thiazol-3-yl]butanoic acid CAS Name: 4-[4-(butylsulfonylmethyl)-2-sulfanylidene-3-thiazolyl]butanoic acid IUPAC Name: 4-[4-(butylsulfonylmethyl)-2-sulfanylidene-1,3-thiazol-3-yl]butanoic acid Traditional Name: 4-[4-(butylsulfonylmethyl)-2-thioxo-4-thiazolin-3-yl]butyric acid Formula: C12H19NO4S3 MolecularWeight: 337.47856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CC1=CSC(=S)N1CCCC(=O)O

Isomeric SMILES

CCCCS(=O)(=O)CC1=CSC(=S)N1CCCC(=O)O

InChI

InChI=1S/C12H19NO4S3/c1-2-3-7-20(16,17)9-10-8-19-12(18)13(10)6-4-5-11(14)15/h8H,2-7,9H2,1H3,(H,14,15)