4-butyl-N-[5-(furan-2-yl)-2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[5-(furan-2-yl)-2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-[5-(2-furyl)-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclohexanecarboxamide CAS Name: 4-butyl-N-[5-(2-furanyl)-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-3-pyrazolyl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-[5-(furan-2-yl)-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-[5-(2-furyl)-2-(4-keto-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclohexanecarboxamide Formula: C28H31N5O3 MolecularWeight: 485.57744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC(=NN2C3=NC(=O)C=C(N3)C4=CC=CC=C4)C5=CC=CO5

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC(=NN2C3=NC(=O)C=C(N3)C4=CC=CC=C4)C5=CC=CO5

InChI

InChI=1S/C28H31N5O3/c1-2-3-8-19-12-14-21(15-13-19)27(35)30-25-17-23(24-11-7-16-36-24)32-33(25)28-29-22(18-26(34)31-28)20-9-5-4-6-10-20/h4-7,9-11,16-19,21H,2-3,8,12-15H2,1H3,(H,30,35)(H,29,31,34)