2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxidanylidene-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxidanylidene-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-6-oxo-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-keto-3-(4-phenoxyphenyl)-4,5-dihydropyrimidine-4-carboxylate Formula: C23H20N5O4- MolecularWeight: 430.436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=NC(=O)CC(N2C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=NC(=O)CC(N2C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)[O-])C

InChI

InChI=1S/C23H21N5O4/c1-14-12-15(2)25-22(24-14)27-23-26-20(29)13-19(21(30)31)28(23)16-8-10-18(11-9-16)32-17-6-4-3-5-7-17/h3-12,19H,13H2,1-2H3,(H,30,31)(H,24,25,26,27,29)/p-1