N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-(5-ethoxy-2-methyl-coumaran-6-yl)-4-keto-4-[4-(methylthio)phenyl]butyramide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4S/c1-4-26-21-12-16-11-14(2)27-20(16)13-18(21)23-22(25)10-9-19(24)15-5-7-17(28-3)8-6-15/h5-8,12-14H,4,9-11H2,1-3H3,(H,23,25)