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

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxidanylidene-4-propyl-pyrimidin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxo-4-propyl-pyrimidin-1-yl]acetamide CAS Name: 2-[2-(3,5-dimethyl-1-pyrazolyl)-6-oxo-4-propyl-1-pyrimidinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[2-(3,5-dimethylpyrazol-1-yl)-6-oxo-4-propylpyrimidin-1-yl]acetamide Traditional Name: N-benzyl-2-[2-(3,5-dimethylpyrazol-1-yl)-6-keto-4-propyl-pyrimidin-1-yl]acetamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O2/c1-4-8-18-12-20(28)25(21(23-18)26-16(3)11-15(2)24-26)14-19(27)22-13-17-9-6-5-7-10-17/h5-7,9-12H,4,8,13-14H2,1-3H3,(H,22,27)