1-[5-chloranyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-oxidanyl-phenyl]ethanone

Systemtic Name: 1-[5-chloranyl-3-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-oxidanyl-phenyl]ethanone Openeye Name: 1-[5-chloro-2-hydroxy-3-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]ethanone CAS Name: 1-[5-chloro-2-hydroxy-3-[[(1-methyl-2-imidazolyl)thio]methyl]phenyl]ethanone IUPAC Name: 1-[5-chloro-2-hydroxy-3-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[5-chloro-2-hydroxy-3-[[(1-methylimidazol-2-yl)thio]methyl]phenyl]ethanone Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1O)CSC2=NC=CN2C)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1O)CSC2=NC=CN2C)Cl

InChI

InChI=1S/C13H13ClN2O2S/c1-8(17)11-6-10(14)5-9(12(11)18)7-19-13-15-3-4-16(13)2/h3-6,18H,7H2,1-2H3