dimethyl (2E,4E,6E)-1-methyl-6-(2-morpholin-4-yl-2-sulfanylidene-ethylidene)-1-benzazocine-3,4-dicarboxylate

Systemtic Name: dimethyl (2E,4E,6E)-1-methyl-6-(2-morpholin-4-yl-2-sulfanylidene-ethylidene)-1-benzazocine-3,4-dicarboxylate Openeye Name: dimethyl (2E,4E,6E)-1-methyl-6-(2-morpholino-2-thioxo-ethylidene)-1-benzazocine-3,4-dicarboxylate CAS Name: (2E,4E,6E)-1-methyl-6-[2-(4-morpholinyl)-2-sulfanylideneethylidene]-1-benzazocine-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2E,4E,6E)-1-methyl-6-(2-morpholin-4-yl-2-sulfanylideneethylidene)-1-benzazocine-3,4-dicarboxylate Traditional Name: (2E,4E,6E)-1-methyl-6-(2-morpholino-2-thioxo-ethylidene)-1-benzazocine-3,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=CC(=CC(=S)N2CCOCC2)C3=CC=CC=C31)C(=O)OC)C(=O)OC

Isomeric SMILES

CN1/C=C(\C(=C/C(=C\C(=S)N2CCOCC2)/C3=CC=CC=C31)\C(=O)OC)/C(=O)OC

InChI

InChI=1S/C22H24N2O5S/c1-23-14-18(22(26)28-3)17(21(25)27-2)12-15(16-6-4-5-7-19(16)23)13-20(30)24-8-10-29-11-9-24/h4-7,12-14H,8-11H2,1-3H3/b15-13+,17-12+,18-14+