methyl 3-[2-[[3-(dimethylsulfamoyl)phenyl]carbonylamino]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-[[3-(dimethylsulfamoyl)phenyl]carbonylamino]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-[[3-(dimethylsulfamoyl)benzoyl]amino]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[[[3-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[[3-(dimethylsulfamoyl)benzoyl]amino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[[3-(dimethylsulfamoyl)benzoyl]amino]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC(=O)NC(CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC(=O)NC(CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O6S/c1-24(2)31(28,29)17-11-7-10-16(12-17)21(27)22-14-19(25)23-18(13-20(26)30-3)15-8-5-4-6-9-15/h4-12,18H,13-14H2,1-3H3,(H,22,27)(H,23,25)