methyl (2S)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[5-(diethylsulfamoyl)-2-methylphenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(diethylsulfamoyl)-2-methylbenzoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C22H28N2O5S/c1-5-24(6-2)30(27,28)18-13-12-16(3)19(15-18)21(25)23-20(22(26)29-4)14-17-10-8-7-9-11-17/h7-13,15,20H,5-6,14H2,1-4H3,(H,23,25)/t20-/m0/s1