(E)-2-methyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]but-2-enamide

Systemtic Name: (E)-2-methyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]but-2-enamide Openeye Name: (E)-2-methyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]but-2-enamide CAS Name: (E)-2-methyl-N-[[(2R)-7-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-butenamide IUPAC Name: (E)-2-methyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]but-2-enamide Traditional Name: (E)-2-methyl-N-[[(2R)-7-(5-pyrimidyl)coumaran-2-yl]methyl]but-2-enamide Formula: C18H19N3O2 MolecularWeight: 309.36236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)NCC1CC2=CC=CC(=C2O1)C3=CN=CN=C3

Isomeric SMILES

C/C=C(\C)/C(=O)NC[C@H]1CC2=CC=CC(=C2O1)C3=CN=CN=C3

InChI

InChI=1S/C18H19N3O2/c1-3-12(2)18(22)21-10-15-7-13-5-4-6-16(17(13)23-15)14-8-19-11-20-9-14/h3-6,8-9,11,15H,7,10H2,1-2H3,(H,21,22)/b12-3+/t15-/m1/s1