N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]oxane-4-carboxamide

Systemtic Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]oxane-4-carboxamide Openeye Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydrobenzofuran-2-yl]methyl]tetrahydropyran-4-carboxamide CAS Name: N-[[(2S)-5-(3,6-dimethyl-2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-oxanecarboxamide IUPAC Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]oxane-4-carboxamide Traditional Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)coumaran-2-yl]methyl]tetrahydropyran-4-carboxamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=CC3=C(C=C2)OC(C3)CNC(=O)C4CCOCC4)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=CC3=C(C=C2)O[C@@H](C3)CNC(=O)C4CCOCC4)C

InChI

InChI=1S/C21H25N3O3/c1-13-11-22-14(2)20(24-13)16-3-4-19-17(9-16)10-18(27-19)12-23-21(25)15-5-7-26-8-6-15/h3-4,9,11,15,18H,5-8,10,12H2,1-2H3,(H,23,25)/t18-/m0/s1