5-[3-[3-(furan-2-yl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[3-(furan-2-yl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[3-(2-furyl)propyl-methylsulfonyl-amino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[3-(2-furanyl)propyl-methylsulfonylamino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[3-(furan-2-yl)propyl-methylsulfonylamino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[3-(2-furyl)propyl-mesyl-amino]propyl]-2-thenoic acid Formula: C16H21NO5S2 MolecularWeight: 371.47164

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC1=CC=CO1)CCCC2=CC=C(S2)C(=O)O

Isomeric SMILES

CS(=O)(=O)N(CCCC1=CC=CO1)CCCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C16H21NO5S2/c1-24(20,21)17(10-2-5-13-6-4-12-22-13)11-3-7-14-8-9-15(23-14)16(18)19/h4,6,8-9,12H,2-3,5,7,10-11H2,1H3,(H,18,19)