4-(1,3-benzodioxol-5-ylcarbonylamino)-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonylamino)-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 4-(1,3-benzodioxole-5-carbonylamino)-1-ethyl-N-isobutyl-pyrazole-3-carboxamide CAS Name: 4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-ethyl-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 4-(1,3-benzodioxole-5-carbonylamino)-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 1-ethyl-N-isobutyl-4-(piperonyloylamino)pyrazole-3-carboxamide Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H22N4O4/c1-4-22-9-13(16(21-22)18(24)19-8-11(2)3)20-17(23)12-5-6-14-15(7-12)26-10-25-14/h5-7,9,11H,4,8,10H2,1-3H3,(H,19,24)(H,20,23)