3,4-dimethoxy-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]benzamide Openeye Name: 3,4-dimethoxy-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]benzamide CAS Name: 3,4-dimethoxy-N-[[(2R)-7-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]benzamide Traditional Name: 3,4-dimethoxy-N-[[(2R)-7-(5-pyrimidyl)coumaran-2-yl]methyl]benzamide Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2CC3=CC=CC(=C3O2)C4=CN=CN=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC[C@H]2CC3=CC=CC(=C3O2)C4=CN=CN=C4)OC

InChI

InChI=1S/C22H21N3O4/c1-27-19-7-6-15(9-20(19)28-2)22(26)25-12-17-8-14-4-3-5-18(21(14)29-17)16-10-23-13-24-11-16/h3-7,9-11,13,17H,8,12H2,1-2H3,(H,25,26)/t17-/m1/s1