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

Systemtic Name: 4-butoxy-N-[2-(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide Openeye Name: 4-butoxy-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide CAS Name: 4-butoxy-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-3-pyrazolyl]benzamide IUPAC Name: 4-butoxy-N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide Traditional Name: 4-butoxy-N-[2-(6-ethyl-4-keto-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]benzamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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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)CC)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O3/c1-4-6-11-29-17-9-7-15(8-10-17)20(28)23-18-12-14(3)25-26(18)21-22-16(5-2)13-19(27)24-21/h7-10,12-13H,4-6,11H2,1-3H3,(H,23,28)(H,22,24,27)