methyl 3-phenyl-2-[[3-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl 3-phenyl-2-[[3-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]propanoate Openeye Name: methyl 3-phenyl-2-[[3-(prop-2-ynylsulfamoyl)benzoyl]amino]propanoate CAS Name: 2-[[oxo-[3-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-phenyl-2-[[3-(prop-2-ynylsulfamoyl)benzoyl]amino]propanoate Traditional Name: 3-phenyl-2-[[3-(propargylsulfamoyl)benzoyl]amino]propionic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

InChI

InChI=1S/C20H20N2O5S/c1-3-12-21-28(25,26)17-11-7-10-16(14-17)19(23)22-18(20(24)27-2)13-15-8-5-4-6-9-15/h1,4-11,14,18,21H,12-13H2,2H3,(H,22,23)