(4-methylsulfanylphenyl)methyl 2-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[[3-(diethylsulfamoyl)phenyl]carbonylamino]-3-methyl-butanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methyl-butanoate CAS Name: 2-[[[3-(diethylsulfamoyl)phenyl]-oxomethyl]amino]-3-methylbutanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methylbutanoate Traditional Name: 2-[[3-(diethylsulfamoyl)benzoyl]amino]-3-methyl-butyric acid [4-(methylthio)benzyl] ester Formula: C24H32N2O5S2 MolecularWeight: 492.65128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C24H32N2O5S2/c1-6-26(7-2)33(29,30)21-10-8-9-19(15-21)23(27)25-22(17(3)4)24(28)31-16-18-11-13-20(32-5)14-12-18/h8-15,17,22H,6-7,16H2,1-5H3,(H,25,27)