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

Systemtic Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohexene-1-carboxamide Openeye Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydrobenzofuran-2-yl]methyl]cyclohexene-1-carboxamide CAS Name: N-[[(2S)-5-(3,6-dimethyl-2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-cyclohexenecarboxamide IUPAC Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclohexene-1-carboxamide Traditional Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)coumaran-2-yl]methyl]cyclohexene-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=CC3=C(C=C2)OC(C3)CNC(=O)C4=CCCCC4)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=CC3=C(C=C2)O[C@@H](C3)CNC(=O)C4=CCCCC4)C

InChI

InChI=1S/C22H25N3O2/c1-14-12-23-15(2)21(25-14)17-8-9-20-18(10-17)11-19(27-20)13-24-22(26)16-6-4-3-5-7-16/h6,8-10,12,19H,3-5,7,11,13H2,1-2H3,(H,24,26)/t19-/m0/s1