2-[4-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]thiazol-5-yl]acetic acid CAS Name: 2-[4-methyl-2-[(1-methyl-4-pyrazolyl)methylthio]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-methyl-2-[(1-methylpyrazol-4-yl)methylsulfanyl]-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-methyl-2-[(1-methylpyrazol-4-yl)methylthio]thiazol-5-yl]acetic acid Formula: C11H13N3O2S2 MolecularWeight: 283.36982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC2=CN(N=C2)C)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC2=CN(N=C2)C)CC(=O)O

InChI

InChI=1S/C11H13N3O2S2/c1-7-9(3-10(15)16)18-11(13-7)17-6-8-4-12-14(2)5-8/h4-5H,3,6H2,1-2H3,(H,15,16)