ethyl 4-[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-oxo-pyrimidin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-(3,5-dimethyl-1-pyrazolyl)-4-ethyl-6-oxo-1-pyrimidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-oxopyrimidin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-keto-pyrimidin-1-yl]acetyl]amino]benzoic acid ethyl ester Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=O)N(C(=N1)N2C(=CC(=N2)C)C)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H25N5O4/c1-5-17-12-20(29)26(22(24-17)27-15(4)11-14(3)25-27)13-19(28)23-18-9-7-16(8-10-18)21(30)31-6-2/h7-12H,5-6,13H2,1-4H3,(H,23,28)