N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-(3-methylphenoxy)acetamide CAS Name: N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-(3-methylphenoxy)acetamide Formula: C28H25N5O3S MolecularWeight: 511.5948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C28H25N5O3S/c1-18-8-6-11-21(14-18)36-17-26(34)30-25-16-23(24-12-7-13-37-24)32-33(25)28-29-19(2)22(27(35)31-28)15-20-9-4-3-5-10-20/h3-14,16H,15,17H2,1-2H3,(H,30,34)(H,29,31,35)