(4-methylsulfanylphenyl)methyl (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate Openeye Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]propionic acid [4-(methylthio)benzyl] ester Formula: C18H21NO5S2 MolecularWeight: 395.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)SC)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=C(C=C1)SC)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H21NO5S2/c1-13(18(20)24-12-14-4-8-16(25-3)9-5-14)19-26(21,22)17-10-6-15(23-2)7-11-17/h4-11,13,19H,12H2,1-3H3/t13-/m0/s1