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

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(methylsulfinylmethyl)benzamide Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-3-(methylsulfinylmethyl)benzamide CAS Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-3-(methylsulfinylmethyl)benzamide IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(methylsulfinylmethyl)benzamide Traditional Name: N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-3-(methylsulfinylmethyl)benzamide Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC(=CC=C3)CS(=O)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC(=CC=C3)CS(=O)C

InChI

InChI=1S/C21H25NO4S/c1-4-25-19-10-17-8-14(2)26-20(17)11-18(19)12-22-21(23)16-7-5-6-15(9-16)13-27(3)24/h5-7,9-11,14H,4,8,12-13H2,1-3H3,(H,22,23)