2-[(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[[1-methyl-3-(2-thienyl)pyrazol-4-yl]methylsulfanyl]acetic acid CAS Name: 2-[(1-methyl-3-thiophen-2-yl-4-pyrazolyl)methylthio]acetic acid IUPAC Name: 2-[(1-methyl-3-thiophen-2-ylpyrazol-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[[1-methyl-3-(2-thienyl)pyrazol-4-yl]methylthio]acetic acid Formula: C11H12N2O2S2 MolecularWeight: 268.35518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CS2)CSCC(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CS2)CSCC(=O)O

InChI

InChI=1S/C11H12N2O2S2/c1-13-5-8(6-16-7-10(14)15)11(12-13)9-3-2-4-17-9/h2-5H,6-7H2,1H3,(H,14,15)