methyl 4-[[methyl-[4-(prop-2-ynylsulfamoyl)phenyl]carbonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-[4-(prop-2-ynylsulfamoyl)phenyl]carbonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-[4-(prop-2-ynylsulfamoyl)benzoyl]amino]methyl]benzoate CAS Name: 4-[[methyl-[oxo-[4-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[4-(prop-2-ynylsulfamoyl)benzoyl]amino]methyl]benzoate Traditional Name: 4-[[methyl-[4-(propargylsulfamoyl)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C

InChI

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