2-[2-[2-(3-azanyl-3-oxidanylidene-propyl)sulfonylethylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(3-azanyl-3-oxidanylidene-propyl)sulfonylethylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-[2-(3-amino-3-oxo-propyl)sulfonylethylsulfanyl]-4-methyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[2-(3-amino-3-oxopropyl)sulfonylethylthio]-4-methyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-(3-amino-3-oxopropyl)sulfonylethylsulfanyl]-4-methyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[2-(3-amino-3-keto-propyl)sulfonylethylthio]-4-methyl-thiazol-5-yl]acetic acid Formula: C11H16N2O5S3 MolecularWeight: 352.45014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCCS(=O)(=O)CCC(=O)N)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCCS(=O)(=O)CCC(=O)N)CC(=O)O

InChI

InChI=1S/C11H16N2O5S3/c1-7-8(6-10(15)16)20-11(13-7)19-3-5-21(17,18)4-2-9(12)14/h2-6H2,1H3,(H2,12,14)(H,15,16)