(4-bromanyl-2-morpholin-4-ylcarbothioyl-phenyl) 4-methoxybenzenesulfonate

Systemtic Name: (4-bromanyl-2-morpholin-4-ylcarbothioyl-phenyl) 4-methoxybenzenesulfonate Openeye Name: [4-bromo-2-(morpholine-4-carbothioyl)phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [4-bromo-2-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-(morpholine-4-carbothioyl)phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [4-bromo-2-(morpholine-4-carbothioyl)phenyl] ester Formula: C18H18BrNO5S2 MolecularWeight: 472.37322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)C(=S)N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)C(=S)N3CCOCC3

InChI

InChI=1S/C18H18BrNO5S2/c1-23-14-3-5-15(6-4-14)27(21,22)25-17-7-2-13(19)12-16(17)18(26)20-8-10-24-11-9-20/h2-7,12H,8-11H2,1H3