(4-chloranyl-2-morpholin-4-ylcarbothioyl-phenyl) 4-bromanylbenzenesulfonate

Systemtic Name: (4-chloranyl-2-morpholin-4-ylcarbothioyl-phenyl) 4-bromanylbenzenesulfonate Openeye Name: [4-chloro-2-(morpholine-4-carbothioyl)phenyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [4-chloro-2-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-chloro-2-(morpholine-4-carbothioyl)phenyl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [4-chloro-2-(morpholine-4-carbothioyl)phenyl] ester Formula: C17H15BrClNO4S2 MolecularWeight: 476.7923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)C2=C(C=CC(=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COCCN1C(=S)C2=C(C=CC(=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrClNO4S2/c18-12-1-4-14(5-2-12)26(21,22)24-16-6-3-13(19)11-15(16)17(25)20-7-9-23-10-8-20/h1-6,11H,7-10H2