N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(methylsulfanylmethyl)benzamide

Systemtic Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(methylsulfanylmethyl)benzamide Openeye Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-4-(methylsulfanylmethyl)benzamide CAS Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-4-[(methylthio)methyl]benzamide IUPAC Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(methylsulfanylmethyl)benzamide Traditional Name: N-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-4-[(methylthio)methyl]benzamide Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)C3=CC=C(C=C3)CSC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NC(=O)C3=CC=C(C=C3)CSC

InChI

InChI=1S/C20H23NO3S/c1-4-23-19-10-16-9-13(2)24-18(16)11-17(19)21-20(22)15-7-5-14(6-8-15)12-25-3/h5-8,10-11,13H,4,9,12H2,1-3H3,(H,21,22)/t13-/m0/s1