(3-morpholin-4-ylsulfonylphenyl)methyl 3-phenylsulfanylpropanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-phenylsulfanylpropanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid (3-morpholinosulfonylbenzyl) ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C20H23NO5S2/c22-20(9-14-27-18-6-2-1-3-7-18)26-16-17-5-4-8-19(15-17)28(23,24)21-10-12-25-13-11-21/h1-8,15H,9-14,16H2