propan-2-yl 3-(4-methylphenyl)-3-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(4-methylphenyl)-3-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]propanoate Openeye Name: isopropyl 3-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-3-[[oxo-[4-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(4-methylphenyl)-3-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]propanoate Traditional Name: 3-[[4-(propargylsulfamoyl)benzoyl]amino]-3-(p-tolyl)propionic acid isopropyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O5S/c1-5-14-24-31(28,29)20-12-10-19(11-13-20)23(27)25-21(15-22(26)30-16(2)3)18-8-6-17(4)7-9-18/h1,6-13,16,21,24H,14-15H2,2-4H3,(H,25,27)