2-[[[(4-methylphenyl)sulfonylamino]-phenyl-methylidene]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[[(4-methylphenyl)sulfonylamino]-phenyl-methylidene]amino]-3-phenyl-propanoic acid Openeye Name: 3-phenyl-2-[[phenyl-(p-tolylsulfonylamino)methylene]amino]propanoic acid CAS Name: 2-[[[(4-methylphenyl)sulfonylamino]-phenylmethylidene]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[[(4-methylphenyl)sulfonylamino]-phenylmethylidene]amino]-3-phenylpropanoic acid Traditional Name: 3-phenyl-2-[[phenyl-(tosylamino)methylene]amino]propionic acid Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NC(CC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NC(CC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H22N2O4S/c1-17-12-14-20(15-13-17)30(28,29)25-22(19-10-6-3-7-11-19)24-21(23(26)27)16-18-8-4-2-5-9-18/h2-15,21H,16H2,1H3,(H,24,25)(H,26,27)