1-[[5-(4-chlorophenyl)thiophen-2-yl]sulfonylamino]-2-(phenylmethyl)cyclopropane-1-carboxylic acid

Systemtic Name: 1-[[5-(4-chlorophenyl)thiophen-2-yl]sulfonylamino]-2-(phenylmethyl)cyclopropane-1-carboxylic acid Openeye Name: 2-benzyl-1-[[5-(4-chlorophenyl)-2-thienyl]sulfonylamino]cyclopropanecarboxylic acid CAS Name: 1-[[5-(4-chlorophenyl)-2-thiophenyl]sulfonylamino]-2-(phenylmethyl)-1-cyclopropanecarboxylic acid IUPAC Name: 2-benzyl-1-[[5-(4-chlorophenyl)thiophen-2-yl]sulfonylamino]cyclopropane-1-carboxylic acid Traditional Name: 2-benzyl-1-[[5-(4-chlorophenyl)-2-thienyl]sulfonylamino]cyclopropanecarboxylic acid Formula: C21H18ClNO4S2 MolecularWeight: 447.95492

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C(=O)O)NS(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C(C1(C(=O)O)NS(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H18ClNO4S2/c22-17-8-6-15(7-9-17)18-10-11-19(28-18)29(26,27)23-21(20(24)25)13-16(21)12-14-4-2-1-3-5-14/h1-11,16,23H,12-13H2,(H,24,25)