2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[2-morpholinoethyl-(4-phenylsulfanylphenyl)sulfonyl-amino]acetic acid CAS Name: 2-[2-(4-morpholinyl)ethyl-[4-(phenylthio)phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[2-morpholin-4-ylethyl-(4-phenylsulfanylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[2-morpholinoethyl-[4-(phenylthio)phenyl]sulfonyl-amino]acetic acid Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

C1COCCN1CCN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5S2/c23-20(24)16-22(11-10-21-12-14-27-15-13-21)29(25,26)19-8-6-18(7-9-19)28-17-4-2-1-3-5-17/h1-9H,10-16H2,(H,23,24)