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

Systemtic Name: N6-(2,3-dihydro-1-benzofuran-5-ylmethyl)-N4-[(1-methylpyrazol-4-yl)methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N6-(2,3-dihydrobenzofuran-5-ylmethyl)-N4-[(1-methylpyrazol-4-yl)methyl]pyrimidine-4,6-dicarboxamide CAS Name: N6-(2,3-dihydrobenzofuran-5-ylmethyl)-N4-[(1-methyl-4-pyrazolyl)methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 6-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-N-[(1-methylpyrazol-4-yl)methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N'-(coumaran-5-ylmethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrimidine-4,6-dicarboxamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CN1C=C(C=N1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C20H20N6O3/c1-26-11-14(10-25-26)9-22-20(28)17-7-16(23-12-24-17)19(27)21-8-13-2-3-18-15(6-13)4-5-29-18/h2-3,6-7,10-12H,4-5,8-9H2,1H3,(H,21,27)(H,22,28)