(4-methylsulfanylphenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-[(4-isopropylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-cumenylsulfonylamino)propionic acid [4-(methylthio)benzyl] ester Formula: C20H25NO4S2 MolecularWeight: 407.5468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C20H25NO4S2/c1-15(2)17-6-10-19(11-7-17)27(23,24)21-13-12-20(22)25-14-16-4-8-18(26-3)9-5-16/h4-11,15,21H,12-14H2,1-3H3