2-[5-(4-chlorophenyl)-1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[5-(4-chlorophenyl)-1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[5-(4-chlorophenyl)-1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(4-chlorophenyl)-1-[2-(1-cyclohexenyl)ethyl]-2-imidazolyl]thio]acetate IUPAC Name: 2-[5-(4-chlorophenyl)-1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[5-(4-chlorophenyl)-1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]thio]acetate Formula: C19H20ClN2O2S- MolecularWeight: 375.8923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=CN=C2SCC(=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(=CC1)CCN2C(=CN=C2SCC(=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN2O2S/c20-16-8-6-15(7-9-16)17-12-21-19(25-13-18(23)24)22(17)11-10-14-4-2-1-3-5-14/h4,6-9,12H,1-3,5,10-11,13H2,(H,23,24)/p-1