2-[2-(2-imidazol-1-ylethylsulfanyl)-4-methyl-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[2-(2-imidazol-1-ylethylsulfanyl)-4-methyl-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[2-(2-imidazol-1-ylethylsulfanyl)-4-methyl-thiazol-5-yl]acetate CAS Name: 2-[2-[2-(1-imidazolyl)ethylthio]-4-methyl-5-thiazolyl]acetate IUPAC Name: 2-[2-(2-imidazol-1-ylethylsulfanyl)-4-methyl-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-(2-imidazol-1-ylethylthio)-4-methyl-thiazol-5-yl]acetate Formula: C11H12N3O2S2- MolecularWeight: 282.36188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCCN2C=CN=C2)CC(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)SCCN2C=CN=C2)CC(=O)[O-]

InChI

InChI=1S/C11H13N3O2S2/c1-8-9(6-10(15)16)18-11(13-8)17-5-4-14-3-2-12-7-14/h2-3,7H,4-6H2,1H3,(H,15,16)/p-1