ethyl 2-[(4-ethanoylphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: ethyl 2-[(4-ethanoylphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: ethyl 2-[(4-acetylphenyl)sulfonylamino]-3-benzylsulfanyl-propanoate CAS Name: 2-[(4-acetylphenyl)sulfonylamino]-3-(phenylmethylthio)propanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-acetylphenyl)sulfonylamino]-3-benzylsulfanylpropanoate Traditional Name: 2-[(4-acetylphenyl)sulfonylamino]-3-(benzylthio)propionic acid ethyl ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C(CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

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