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

Systemtic Name: methyl 4-[2-[2-(3,5-dimethylpyrazol-1-yl)-4-ethyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H23N5O4 MolecularWeight: 409.43842

Click to see the large picture

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)OC

Isomeric SMILES

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

InChI

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