2-[(2,5-dimethyl-4-morpholin-4-ylsulfonyl-furan-3-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2,5-dimethyl-4-morpholin-4-ylsulfonyl-furan-3-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2,5-dimethyl-4-morpholinosulfonyl-3-furyl)methylsulfanyl]acetic acid CAS Name: 2-[[2,5-dimethyl-4-(4-morpholinylsulfonyl)-3-furanyl]methylthio]acetic acid IUPAC Name: 2-[(2,5-dimethyl-4-morpholin-4-ylsulfonylfuran-3-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2,5-dimethyl-4-morpholinosulfonyl-3-furyl)methylthio]acetic acid Formula: C13H19NO6S2 MolecularWeight: 349.42306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCOCC2)CSCC(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCOCC2)CSCC(=O)O

InChI

InChI=1S/C13H19NO6S2/c1-9-11(7-21-8-12(15)16)13(10(2)20-9)22(17,18)14-3-5-19-6-4-14/h3-8H2,1-2H3,(H,15,16)