tert-butyl 2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: tert-butyl 2-[5-(4-chlorophenyl)-1-(o-tolyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(4-chlorophenyl)-1-(2-methylphenyl)-2-imidazolyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[5-(4-chlorophenyl)-1-(o-tolyl)imidazol-2-yl]thio]acetic acid tert-butyl ester Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CN=C2SCC(=O)OC(C)(C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=CN=C2SCC(=O)OC(C)(C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O2S/c1-15-7-5-6-8-18(15)25-19(16-9-11-17(23)12-10-16)13-24-21(25)28-14-20(26)27-22(2,3)4/h5-13H,14H2,1-4H3