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

Systemtic Name: methyl 4-[2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxo-pyrimidin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-(3,5-dimethyl-1-pyrazolyl)-4,5-dimethyl-6-oxo-1-pyrimidinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-(3,5-dimethylpyrazol-1-yl)-6-keto-4,5-dimethyl-pyrimidin-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=C(C(=O)N2CC(=O)NC3=CC=C(C=C3)C(=O)OC)C)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NC(=C(C(=O)N2CC(=O)NC3=CC=C(C=C3)C(=O)OC)C)C)C

InChI

InChI=1S/C21H23N5O4/c1-12-10-13(2)26(24-12)21-22-15(4)14(3)19(28)25(21)11-18(27)23-17-8-6-16(7-9-17)20(29)30-5/h6-10H,11H2,1-5H3,(H,23,27)