2-methyl-4-[1-[4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethoxy)phenyl]butan-2-ylamino]pyrimidine-5-carboxylic acid

Systemtic Name: 2-methyl-4-[1-[4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethoxy)phenyl]butan-2-ylamino]pyrimidine-5-carboxylic acid Openeye Name: 4-[1-[[4-(2-hydroxy-2-oxo-1-phenyl-ethoxy)phenyl]methyl]propylamino]-2-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-[1-[4-(2-hydroxy-2-oxo-1-phenylethoxy)phenyl]butan-2-ylamino]-2-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[1-[4-(2-hydroxy-2-oxo-1-phenylethoxy)phenyl]butan-2-ylamino]-2-methylpyrimidine-5-carboxylic acid Traditional Name: 4-[1-[4-(2-hydroxy-2-keto-1-phenyl-ethoxy)benzyl]propylamino]-2-methyl-pyrimidine-5-carboxylic acid Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)OC(C2=CC=CC=C2)C(=O)O)NC3=NC(=NC=C3C(=O)O)C

Isomeric SMILES

CCC(CC1=CC=C(C=C1)OC(C2=CC=CC=C2)C(=O)O)NC3=NC(=NC=C3C(=O)O)C

InChI

InChI=1S/C24H25N3O5/c1-3-18(27-22-20(23(28)29)14-25-15(2)26-22)13-16-9-11-19(12-10-16)32-21(24(30)31)17-7-5-4-6-8-17/h4-12,14,18,21H,3,13H2,1-2H3,(H,28,29)(H,30,31)(H,25,26,27)