(2E)-5-(2,2-dimethylpropanoyl)-2-[[2-(4-methoxyphenyl)ethylamino]-oxidanyl-methylidene]-4-oxidanyl-thiophen-3-one

Systemtic Name: (2E)-5-(2,2-dimethylpropanoyl)-2-[[2-(4-methoxyphenyl)ethylamino]-oxidanyl-methylidene]-4-oxidanyl-thiophen-3-one Openeye Name: (2E)-5-(2,2-dimethylpropanoyl)-4-hydroxy-2-[hydroxy-[2-(4-methoxyphenyl)ethylamino]methylene]thiophen-3-one CAS Name: (2E)-5-(2,2-dimethyl-1-oxopropyl)-4-hydroxy-2-[hydroxy-[2-(4-methoxyphenyl)ethylamino]methylidene]-3-thiophenone IUPAC Name: (2E)-5-(2,2-dimethylpropanoyl)-4-hydroxy-2-[hydroxy-[2-(4-methoxyphenyl)ethylamino]methylidene]thiophen-3-one Traditional Name: (2E)-4-hydroxy-2-[hydroxy-[2-(4-methoxyphenyl)ethylamino]methylene]-5-pivaloyl-thiophen-3-one Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=C(C(=O)C(=C(NCCC2=CC=C(C=C2)OC)O)S1)O

Isomeric SMILES

CC(C)(C)C(=O)C1=C(C(=O)/C(=C(/NCCC2=CC=C(C=C2)OC)\O)/S1)O

InChI

InChI=1S/C19H23NO5S/c1-19(2,3)17(23)15-13(21)14(22)16(26-15)18(24)20-10-9-11-5-7-12(25-4)8-6-11/h5-8,20-21,24H,9-10H2,1-4H3/b18-16+