2-[5-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]-2-thienyl]acetic acid CAS Name: 2-[5-[[3-(3-chlorophenyl)propyl-methylsulfonylamino]methyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[[3-(3-chlorophenyl)propyl-methylsulfonylamino]methyl]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[[3-(3-chlorophenyl)propyl-mesyl-amino]methyl]-2-thienyl]acetic acid Formula: C17H20ClNO4S2 MolecularWeight: 401.928

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC1=CC(=CC=C1)Cl)CC2=CC=C(S2)CC(=O)O

Isomeric SMILES

CS(=O)(=O)N(CCCC1=CC(=CC=C1)Cl)CC2=CC=C(S2)CC(=O)O

InChI

InChI=1S/C17H20ClNO4S2/c1-25(22,23)19(9-3-5-13-4-2-6-14(18)10-13)12-16-8-7-15(24-16)11-17(20)21/h2,4,6-8,10H,3,5,9,11-12H2,1H3,(H,20,21)