2-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[(2-chlorophenyl)methyl]-2-imidazolyl]thio]acetate IUPAC Name: 2-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2-chlorobenzyl)imidazol-2-yl]thio]acetate Formula: C12H10ClN2O2S- MolecularWeight: 281.738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CN=C2SCC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CN=C2SCC(=O)[O-])Cl

InChI

InChI=1S/C12H11ClN2O2S/c13-10-4-2-1-3-9(10)7-15-6-5-14-12(15)18-8-11(16)17/h1-6H,7-8H2,(H,16,17)/p-1