(3-morpholin-4-ylsulfonylphenyl)methyl 2-ethylsulfanylbenzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-ethylsulfanylbenzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-ethylsulfanylbenzoate CAS Name: 2-(ethylthio)benzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-ethylsulfanylbenzoate Traditional Name: 2-(ethylthio)benzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23NO5S2/c1-2-27-19-9-4-3-8-18(19)20(22)26-15-16-6-5-7-17(14-16)28(23,24)21-10-12-25-13-11-21/h3-9,14H,2,10-13,15H2,1H3