(4-morpholin-4-ylcarbothioylphenyl) 4-chloranylbenzenesulfonate

Systemtic Name: (4-morpholin-4-ylcarbothioylphenyl) 4-chloranylbenzenesulfonate Openeye Name: [4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-(morpholine-4-carbothioyl)phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [4-(morpholine-4-carbothioyl)phenyl] ester Formula: C17H16ClNO4S2 MolecularWeight: 397.89624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO4S2/c18-14-3-7-16(8-4-14)25(20,21)23-15-5-1-13(2-6-15)17(24)19-9-11-22-12-10-19/h1-8H,9-12H2