2-[2-(4-cyanopyridin-2-yl)sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[2-(4-cyanopyridin-2-yl)sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[2-[(4-cyano-2-pyridyl)sulfanyl]-4-methyl-thiazol-5-yl]acetate CAS Name: 2-[2-[(4-cyano-2-pyridinyl)thio]-4-methyl-5-thiazolyl]acetate IUPAC Name: 2-[2-(4-cyanopyridin-2-yl)sulfanyl-4-methyl-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-[(4-cyano-2-pyridyl)thio]-4-methyl-thiazol-5-yl]acetate Formula: C12H8N3O2S2- MolecularWeight: 290.34082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC2=NC=CC(=C2)C#N)CC(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)SC2=NC=CC(=C2)C#N)CC(=O)[O-]

InChI

InChI=1S/C12H9N3O2S2/c1-7-9(5-11(16)17)18-12(15-7)19-10-4-8(6-13)2-3-14-10/h2-4H,5H2,1H3,(H,16,17)/p-1