5-(1,3-benzodioxol-5-ylcarbonylamino)-2-(methylamino)-1,3-thiazole-4-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylcarbonylamino)-2-(methylamino)-1,3-thiazole-4-carboxamide Openeye Name: 5-(1,3-benzodioxole-5-carbonylamino)-2-(methylamino)thiazole-4-carboxamide CAS Name: 5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-2-(methylamino)-4-thiazolecarboxamide IUPAC Name: 5-(1,3-benzodioxole-5-carbonylamino)-2-(methylamino)-1,3-thiazole-4-carboxamide Traditional Name: 2-(methylamino)-5-(piperonyloylamino)thiazole-4-carboxamide Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

CNC1=NC(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N

InChI

InChI=1S/C13H12N4O4S/c1-15-13-16-9(10(14)18)12(22-13)17-11(19)6-2-3-7-8(4-6)21-5-20-7/h2-4H,5H2,1H3,(H2,14,18)(H,15,16)(H,17,19)