ethyl 2-butyl-3-[(5-chloranyl-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinyl-imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-3-[(5-chloranyl-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinyl-imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-3-[(5-chloro-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinyl-imidazole-4-carboxylate CAS Name: 2-butyl-3-[(5-chloro-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-[(5-chloro-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinylimidazole-4-carboxylate Traditional Name: 2-butyl-3-[(5-chloro-1,3-benzodioxol-2-yl)methyl]-5-methylsulfinyl-imidazole-4-carboxylic acid ethyl ester Formula: C19H23ClN2O5S MolecularWeight: 426.91432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2OC3=C(O2)C=C(C=C3)Cl)C(=O)OCC)S(=O)C

Isomeric SMILES

CCCCC1=NC(=C(N1CC2OC3=C(O2)C=C(C=C3)Cl)C(=O)OCC)S(=O)C

InChI

InChI=1S/C19H23ClN2O5S/c1-4-6-7-15-21-18(28(3)24)17(19(23)25-5-2)22(15)11-16-26-13-9-8-12(20)10-14(13)27-16/h8-10,16H,4-7,11H2,1-3H3