3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-imidazol-1-yl-ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-imidazol-1-yl-ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-imidazol-1-yl-ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-(1-imidazolyl)ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-imidazol-1-ylethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[(4-chlorophenyl)sulfonylamino]-1-imidazol-1-yl-ethyl]phenyl]propionic acid Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)N3C=CN=C3

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)N3C=CN=C3

InChI

InChI=1S/C20H20ClN3O4S/c21-17-6-8-18(9-7-17)29(27,28)23-13-19(24-12-11-22-14-24)16-4-1-15(2-5-16)3-10-20(25)26/h1-2,4-9,11-12,14,19,23H,3,10,13H2,(H,25,26)