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

Systemtic Name: 2-[[1,3-benzodioxol-5-ylcarbonyl(propyl)amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxole-5-carbonyl(propyl)amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[1,3-benzodioxol-5-yl(oxo)methyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxole-5-carbonyl(propyl)amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[piperonyloyl(propyl)amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H23N3O4S/c1-3-7-20-18(23)14-11-27-17(21-14)10-22(8-4-2)19(24)13-5-6-15-16(9-13)26-12-25-15/h5-6,9,11H,3-4,7-8,10,12H2,1-2H3,(H,20,23)