N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide CAS Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-5-[[(1-methyl-2-imidazolyl)thio]methyl]-2-furancarboxamide IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide Traditional Name: N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-5-[[(1-methylimidazol-2-yl)thio]methyl]-2-furamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC=C(O3)CSC4=NC=CN4C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=CC=C(O3)CSC4=NC=CN4C

InChI

InChI=1S/C22H25N3O4S/c1-4-27-19-10-15-9-14(2)28-20(15)11-16(19)12-24-21(26)18-6-5-17(29-18)13-30-22-23-7-8-25(22)3/h5-8,10-11,14H,4,9,12-13H2,1-3H3,(H,24,26)