5-[3-[3-(1H-indol-3-yl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[3-(1H-indol-3-yl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[3-(1H-indol-3-yl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[3-(1H-indol-3-yl)propyl-methylsulfonylamino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[3-(1H-indol-3-yl)propyl-methylsulfonylamino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[3-(1H-indol-3-yl)propyl-mesyl-amino]propyl]-2-thenoic acid Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC1=CC=C(S1)C(=O)O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)N(CCCC1=CC=C(S1)C(=O)O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C20H24N2O4S2/c1-28(25,26)22(13-5-7-16-10-11-19(27-16)20(23)24)12-4-6-15-14-21-18-9-3-2-8-17(15)18/h2-3,8-11,14,21H,4-7,12-13H2,1H3,(H,23,24)