(4-methylsulfanylphenyl) 4-ethyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl) 4-ethyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-methylsulfanylphenyl) 4-ethyl-3-morpholinosulfonyl-benzoate CAS Name: 4-ethyl-3-(4-morpholinylsulfonyl)benzoic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 4-ethyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-ethyl-3-morpholinosulfonyl-benzoic acid [4-(methylthio)phenyl] ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)SC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)SC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23NO5S2/c1-3-15-4-5-16(20(22)26-17-6-8-18(27-2)9-7-17)14-19(15)28(23,24)21-10-12-25-13-11-21/h4-9,14H,3,10-13H2,1-2H3