2-[4-methyl-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-methyl-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-methyl-2-[2-oxo-2-(2-thienylmethylamino)ethyl]sulfanyl-thiazol-5-yl]acetic acid CAS Name: 2-[4-methyl-2-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]thio]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-methyl-2-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[[2-keto-2-(2-thenylamino)ethyl]thio]-4-methyl-thiazol-5-yl]acetic acid Formula: C13H14N2O3S3 MolecularWeight: 342.45686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC(=O)NCC2=CC=CS2)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC(=O)NCC2=CC=CS2)CC(=O)O

InChI

InChI=1S/C13H14N2O3S3/c1-8-10(5-12(17)18)21-13(15-8)20-7-11(16)14-6-9-3-2-4-19-9/h2-4H,5-7H2,1H3,(H,14,16)(H,17,18)