dimethyl 5-[2,5-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2,5-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2,5-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylacetyl]pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[2,5-dimethyl-3-[1-oxo-2-[(1-propyl-2-imidazolyl)thio]ethyl]-1-pyrrolyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2,5-dimethyl-3-[2-(1-propylimidazol-2-yl)sulfanylacetyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[2,5-dimethyl-3-[2-[(1-propylimidazol-2-yl)thio]acetyl]pyrrol-1-yl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)C2=C(N(C(=C2)C)C3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)C2=C(N(C(=C2)C)C3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C

InChI

InChI=1S/C24H27N3O5S/c1-6-8-26-9-7-25-24(26)33-14-21(28)20-10-15(2)27(16(20)3)19-12-17(22(29)31-4)11-18(13-19)23(30)32-5/h7,9-13H,6,8,14H2,1-5H3