(2-chloranyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 4-chloranylbenzenesulfonate

Systemtic Name: (2-chloranyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 4-chloranylbenzenesulfonate Openeye Name: [2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [2-chloro-6-methoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C18H17Cl2NO5S2 MolecularWeight: 462.36728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17Cl2NO5S2/c1-24-16-11-12(18(27)21-6-8-25-9-7-21)10-15(20)17(16)26-28(22,23)14-4-2-13(19)3-5-14/h2-5,10-11H,6-9H2,1H3