N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]ethanediamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]ethanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]oxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-3-pyrazolyl]oxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]oxamide Traditional Name: N'-[2-(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-N-piperonyl-oxamide Formula: C21H22N6O5 MolecularWeight: 438.43658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)N2C(=CC(=N2)C)NC(=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)N2C(=CC(=N2)C)NC(=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H22N6O5/c1-4-14-12(3)23-21(25-18(14)28)27-17(7-11(2)26-27)24-20(30)19(29)22-9-13-5-6-15-16(8-13)32-10-31-15/h5-8H,4,9-10H2,1-3H3,(H,22,29)(H,24,30)(H,23,25,28)