4-butoxy-N-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide Openeye Name: 4-butoxy-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide CAS Name: 4-butoxy-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-3-pyrazolyl]benzamide IUPAC Name: 4-butoxy-N-[2-(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide Traditional Name: 4-butoxy-N-[2-(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC)C

InChI

InChI=1S/C22H27N5O3/c1-5-7-12-30-17-10-8-16(9-11-17)20(28)24-19-13-14(3)26-27(19)22-23-15(4)18(6-2)21(29)25-22/h8-11,13H,5-7,12H2,1-4H3,(H,24,28)(H,23,25,29)