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5-[3-[1-benzofuran-2-ylmethyl(methylsulfonyl)amino]propyl]thiophene-2-carboxylic acid

5-[3-[1-benzofuran-2-ylmethyl(methylsulfonyl)amino]propyl]thiophene-2-carboxylic acid

Systemtic Name:5-[3-[1-benzofuran-2-ylmethyl(methylsulfonyl)amino]propyl]thiophene-2-carboxylic acid
Openeye Name:5-[3-[benzofuran-2-ylmethyl(methylsulfonyl)amino]propyl]thiophene-2-carboxylic acid
CAS Name:5-[3-[2-benzofuranylmethyl(methylsulfonyl)amino]propyl]-2-thiophenecarboxylic acid
IUPAC Name:5-[3-[1-benzofuran-2-ylmethyl(methylsulfonyl)amino]propyl]thiophene-2-carboxylic acid
Traditional Name:5-[3-[benzofuran-2-ylmethyl(mesyl)amino]propyl]-2-thenoic acid
Formula: C18H19NO5S2
MolecularWeight: 393.47716
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC1=CC=C(S1)C(=O)O)CC2=CC3=CC=CC=C3O2


Isomeric SMILES

CS(=O)(=O)N(CCCC1=CC=C(S1)C(=O)O)CC2=CC3=CC=CC=C3O2


InChI

InChI=1S/C18H19NO5S2/c1-26(22,23)19(10-4-6-15-8-9-17(25-15)18(20)21)12-14-11-13-5-2-3-7-16(13)24-14/h2-3,5,7-9,11H,4,6,10,12H2,1H3,(H,20,21)


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