2-[[1-[(4-tert-butylphenyl)methyl]-6-oxidanyl-4-oxidanylidene-2-pyridin-4-yl-pyrimidin-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-[(4-tert-butylphenyl)methyl]-6-oxidanyl-4-oxidanylidene-2-pyridin-4-yl-pyrimidin-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-[(4-tert-butylphenyl)methyl]-6-hydroxy-4-oxo-2-(4-pyridyl)pyrimidine-5-carbonyl]amino]acetic acid CAS Name: 2-[[[1-[(4-tert-butylphenyl)methyl]-6-hydroxy-4-oxo-2-pyridin-4-yl-5-pyrimidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-[(4-tert-butylphenyl)methyl]-6-hydroxy-4-oxo-2-pyridin-4-ylpyrimidine-5-carbonyl]amino]acetic acid Traditional Name: 2-[[1-(4-tert-butylbenzyl)-6-hydroxy-4-keto-2-(4-pyridyl)pyrimidine-5-carbonyl]amino]acetic acid Formula: C23H24N4O5 MolecularWeight: 436.46046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C(=C(C(=O)N=C2C3=CC=NC=C3)C(=O)NCC(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C(=C(C(=O)N=C2C3=CC=NC=C3)C(=O)NCC(=O)O)O

InChI

InChI=1S/C23H24N4O5/c1-23(2,3)16-6-4-14(5-7-16)13-27-19(15-8-10-24-11-9-15)26-21(31)18(22(27)32)20(30)25-12-17(28)29/h4-11,32H,12-13H2,1-3H3,(H,25,30)(H,28,29)