N-[[(2R)-5-(2-ethanoylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-methylsulfanyl-benzamide

Systemtic Name: N-[[(2R)-5-(2-ethanoylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-methylsulfanyl-benzamide Openeye Name: N-[[(2R)-5-(2-acetylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-methylsulfanyl-benzamide CAS Name: N-[[(2R)-5-(2-acetylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-(methylthio)benzamide IUPAC Name: N-[[(2R)-5-(2-acetylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-methylsulfanylbenzamide Traditional Name: N-[[(2R)-5-(2-acetylphenyl)coumaran-2-yl]methyl]-4-(methylthio)benzamide Formula: C25H23NO3S MolecularWeight: 417.52002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1C2=CC3=C(C=C2)OC(C3)CNC(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CC(=O)C1=CC=CC=C1C2=CC3=C(C=C2)O[C@H](C3)CNC(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H23NO3S/c1-16(27)22-5-3-4-6-23(22)18-9-12-24-19(13-18)14-20(29-24)15-26-25(28)17-7-10-21(30-2)11-8-17/h3-13,20H,14-15H2,1-2H3,(H,26,28)/t20-/m1/s1