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

Systemtic Name: ethyl 4-[2-[4-(4-methylphenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[6-oxo-4-(p-tolyl)pyrimidin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[4-(4-methylphenyl)-6-oxo-1-pyrimidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(4-methylphenyl)-6-oxopyrimidin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[6-keto-4-(p-tolyl)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=C(C=C1)NC(=O)CN2C=NC(=CC2=O)C3=CC=C(C=C3)C

Isomeric SMILES

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

InChI

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