ethyl 2-[2-(2-methyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-(2-methyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-(2-methyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetyl]amino]benzoate CAS Name: 2-[[2-(2-methyl-6-oxo-4-phenyl-1-pyrimidinyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-methyl-6-oxo-4-phenylpyrimidin-1-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(6-keto-2-methyl-4-phenyl-pyrimidin-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN2C(=NC(=CC2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN2C(=NC(=CC2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H21N3O4/c1-3-29-22(28)17-11-7-8-12-18(17)24-20(26)14-25-15(2)23-19(13-21(25)27)16-9-5-4-6-10-16/h4-13H,3,14H2,1-2H3,(H,24,26)