2-(1,3-benzodioxol-5-ylcarbonylamino)-N-[3-(dimethylamino)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)-N-[3-(dimethylamino)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-[3-(dimethylamino)propyl]thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-N-[3-(dimethylamino)propyl]-4-thiazolecarboxamide IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-[3-(dimethylamino)propyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[3-(dimethylamino)propyl]-2-(piperonyloylamino)thiazole-4-carboxamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O4S/c1-21(2)7-3-6-18-16(23)12-9-26-17(19-12)20-15(22)11-4-5-13-14(8-11)25-10-24-13/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,18,23)(H,19,20,22)