
 3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(2-thienyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one

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    4.6094   -7.7289    1.8855 H   0  0  0  0  0
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M  END

>  <Chemical Name>
3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(2-thienyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one

>  <PubChem CID>
663185

>  <Formula>
C17H17NO5S2

>  <Molecular Weight>
379.445000

>  <IUPAC Name>
4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(thiophene-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-5-one

>  <XlogP>
1.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
C1=CSC(=C1)C2C(=C(C(=O)N2CCOCCO)O)C(=O)C3=CC=CS3

>  <Isomeric SMILES>
C1=CSC(=C1)C2C(=C(C(=O)N2CCOCCO)O)C(=O)C3=CC=CS3

>  <InChI Std. ID>
InChI=1S/C17H17NO5S2/c19-6-8-23-7-5-18-14(11-3-1-9-24-11)13(16(21)17(18)22)15(20)12-4-2-10-25-12/h1-4,9-10,14,19,21H,5-8H2

>  <InChI Key>
AOPHYELNPJEHSH-UHFFFAOYSA-N

