ethyl 2-[[1,3-benzodioxol-5-ylcarbonyl(pentyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[1,3-benzodioxol-5-ylcarbonyl(pentyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[1,3-benzodioxole-5-carbonyl(pentyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[1,3-benzodioxol-5-yl(oxo)methyl]-pentylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1,3-benzodioxole-5-carbonyl(pentyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl(piperonyloyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H24N2O5S/c1-3-5-6-9-22(11-18-21-15(12-28-18)20(24)25-4-2)19(23)14-7-8-16-17(10-14)27-13-26-16/h7-8,10,12H,3-6,9,11,13H2,1-2H3