2-[[1,3-benzodioxol-5-ylcarbonyl(3-methoxypropyl)amino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[1,3-benzodioxol-5-ylcarbonyl(3-methoxypropyl)amino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxole-5-carbonyl(3-methoxypropyl)amino]methyl]-N-(3-methoxypropyl)thiazole-4-carboxamide CAS Name: 2-[[[1,3-benzodioxol-5-yl(oxo)methyl]-(3-methoxypropyl)amino]methyl]-N-(3-methoxypropyl)-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxole-5-carbonyl(3-methoxypropyl)amino]methyl]-N-(3-methoxypropyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(3-methoxypropyl)-2-[[3-methoxypropyl(piperonyloyl)amino]methyl]thiazole-4-carboxamide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCCCNC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H27N3O6S/c1-27-9-3-7-22-20(25)16-13-31-19(23-16)12-24(8-4-10-28-2)21(26)15-5-6-17-18(11-15)30-14-29-17/h5-6,11,13H,3-4,7-10,12,14H2,1-2H3,(H,22,25)