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3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenyl]propanoic acid

3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenyl]propanoic acid

Systemtic Name:3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenyl]propanoic acid
Openeye Name:3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenyl]propanoic acid
CAS Name:3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylthio]phenyl]propanoic acid
IUPAC Name:3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenyl]propanoic acid
Traditional Name:3-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylthio]phenyl]propionic acid
Formula: C19H22N2O5S2
MolecularWeight: 422.51838
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)CCC(=O)O


Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)CCC(=O)O


InChI

InChI=1S/C19H22N2O5S2/c1-14(22)21-16-5-9-18(10-6-16)28(25,26)20-12-13-27-17-7-2-15(3-8-17)4-11-19(23)24/h2-3,5-10,20H,4,11-13H2,1H3,(H,21,22)(H,23,24)


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