2-[[5-(dodecylsulfamoyl)thiophen-2-yl]methyl-[(4-phenoxyphenyl)methyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[5-(dodecylsulfamoyl)thiophen-2-yl]methyl-[(4-phenoxyphenyl)methyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[5-(dodecylsulfamoyl)-2-thienyl]methyl-[(4-phenoxyphenyl)methyl]amino]-2-oxo-acetic acid CAS Name: 2-[[5-(dodecylsulfamoyl)-2-thiophenyl]methyl-[(4-phenoxyphenyl)methyl]amino]-2-oxoacetic acid IUPAC Name: 2-[[5-(dodecylsulfamoyl)thiophen-2-yl]methyl-[(4-phenoxyphenyl)methyl]amino]-2-oxoacetic acid Traditional Name: 2-keto-2-[[5-(laurylsulfamoyl)-2-thienyl]methyl-(4-phenoxybenzyl)amino]acetic acid Formula: C32H42N2O6S2 MolecularWeight: 614.81568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNS(=O)(=O)C1=CC=C(S1)CN(CC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCNS(=O)(=O)C1=CC=C(S1)CN(CC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C(=O)O

InChI

InChI=1S/C32H42N2O6S2/c1-2-3-4-5-6-7-8-9-10-14-23-33-42(38,39)30-22-21-29(41-30)25-34(31(35)32(36)37)24-26-17-19-28(20-18-26)40-27-15-12-11-13-16-27/h11-13,15-22,33H,2-10,14,23-25H2,1H3,(H,36,37)