N4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-N6-[[4-(oxidanylcarbamoyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-N6-[[4-(oxidanylcarbamoyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4-(2,3-dihydrobenzofuran-5-ylmethyl)-N6-[[4-(hydroxycarbamoyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4-(2,3-dihydrobenzofuran-5-ylmethyl)-N6-[[4-[(hydroxyamino)-oxomethyl]phenyl]methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-N-[[4-(hydroxycarbamoyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N-(coumaran-5-ylmethyl)-N'-[4-(hydroxycarbamoyl)benzyl]pyrimidine-4,6-dicarboxamide Formula: C23H21N5O5 MolecularWeight: 447.44334

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CNC(=O)C3=NC=NC(=C3)C(=O)NCC4=CC=C(C=C4)C(=O)NO

Isomeric SMILES

C1COC2=C1C=C(C=C2)CNC(=O)C3=NC=NC(=C3)C(=O)NCC4=CC=C(C=C4)C(=O)NO

InChI

InChI=1S/C23H21N5O5/c29-21(28-32)16-4-1-14(2-5-16)11-24-22(30)18-10-19(27-13-26-18)23(31)25-12-15-3-6-20-17(9-15)7-8-33-20/h1-6,9-10,13,32H,7-8,11-12H2,(H,24,30)(H,25,31)(H,28,29)