2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxidanylidene-4-propyl-pyrimidin-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxidanylidene-4-propyl-pyrimidin-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxo-4-propyl-pyrimidin-1-yl]-N-phenethyl-acetamide CAS Name: 2-[2-(3,5-dimethyl-1-pyrazolyl)-6-oxo-4-propyl-1-pyrimidinyl]-N-phenethylacetamide IUPAC Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxo-4-propylpyrimidin-1-yl]-N-phenethylacetamide Traditional Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-6-keto-4-propyl-pyrimidin-1-yl]-N-phenethyl-acetamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N5O2/c1-4-8-19-14-21(29)26(22(24-19)27-17(3)13-16(2)25-27)15-20(28)23-12-11-18-9-6-5-7-10-18/h5-7,9-10,13-14H,4,8,11-12,15H2,1-3H3,(H,23,28)