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

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-phenylsulfanylethanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid (3-morpholinosulfonylbenzyl) ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CSC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C19H21NO5S2/c21-19(15-26-17-6-2-1-3-7-17)25-14-16-5-4-8-18(13-16)27(22,23)20-9-11-24-12-10-20/h1-8,13H,9-12,14-15H2