tert-butyl 2-[2-[(2-butyl-3-methyl-2H-imidazol-1-yl)carbothioyl]-5-methoxy-phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[2-[(2-butyl-3-methyl-2H-imidazol-1-yl)carbothioyl]-5-methoxy-phenoxy]ethanoate Openeye Name: tert-butyl 2-[2-(2-butyl-3-methyl-2H-imidazole-1-carbothioyl)-5-methoxy-phenoxy]acetate CAS Name: 2-[2-[(2-butyl-3-methyl-2H-imidazol-1-yl)-sulfanylidenemethyl]-5-methoxyphenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(2-butyl-3-methyl-2H-imidazole-1-carbothioyl)-5-methoxyphenoxy]acetate Traditional Name: 2-[2-(2-butyl-3-methyl-4-imidazoline-1-carbothioyl)-5-methoxy-phenoxy]acetic acid tert-butyl ester Formula: C22H32N2O4S MolecularWeight: 420.56548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C=CN1C(=S)C2=C(C=C(C=C2)OC)OCC(=O)OC(C)(C)C)C

Isomeric SMILES

CCCCC1N(C=CN1C(=S)C2=C(C=C(C=C2)OC)OCC(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H32N2O4S/c1-7-8-9-19-23(5)12-13-24(19)21(29)17-11-10-16(26-6)14-18(17)27-15-20(25)28-22(2,3)4/h10-14,19H,7-9,15H2,1-6H3