3-[(4-methylphenyl)sulfonylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(p-tolylsulfonylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-[(4-methylphenyl)sulfonylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(2-thienyl)-3-(tosylamino)propionic acid Formula: C14H15NO4S2 MolecularWeight: 325.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C14H15NO4S2/c1-10-4-6-11(7-5-10)21(18,19)15-12(9-14(16)17)13-3-2-8-20-13/h2-8,12,15H,9H2,1H3,(H,16,17)