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

Systemtic Name: 4-butoxy-N-[5-methyl-2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 4-butoxy-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]benzamide CAS Name: 4-butoxy-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-3-pyrazolyl]benzamide IUPAC Name: 4-butoxy-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 4-butoxy-N-[2-(4-keto-6-propyl-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)CCC)C

Isomeric SMILES

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

InChI

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