(1S)-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[[(2R)-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-[[(2R)-7-(2-pyrimidyl)coumaran-2-yl]methyl]cyclohex-3-ene-1-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NCC2CC3=CC=CC(=C3O2)C4=NC=CC=N4

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)NC[C@H]2CC3=CC=CC(=C3O2)C4=NC=CC=N4

InChI

InChI=1S/C20H21N3O2/c24-20(14-6-2-1-3-7-14)23-13-16-12-15-8-4-9-17(18(15)25-16)19-21-10-5-11-22-19/h1-2,4-5,8-11,14,16H,3,6-7,12-13H2,(H,23,24)/t14-,16-/m1/s1