3-[3-[3-(2-azanylimidazol-1-yl)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid

Systemtic Name: 3-[3-[3-(2-azanylimidazol-1-yl)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid Openeye Name: 3-[3-[3-(2-aminoimidazol-1-yl)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid CAS Name: 3-[3-[3-(2-amino-1-imidazolyl)phenyl]phenyl]sulfonyl-3-phenylpropanoic acid IUPAC Name: 3-[3-[3-(2-aminoimidazol-1-yl)phenyl]phenyl]sulfonyl-3-phenylpropanoic acid Traditional Name: 3-[3-[3-(2-aminoimidazol-1-yl)phenyl]phenyl]sulfonyl-3-phenyl-propionic acid Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)S(=O)(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)N4C=CN=C4N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)S(=O)(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)N4C=CN=C4N

InChI

InChI=1S/C24H21N3O4S/c25-24-26-12-13-27(24)20-10-4-8-18(14-20)19-9-5-11-21(15-19)32(30,31)22(16-23(28)29)17-6-2-1-3-7-17/h1-15,22H,16H2,(H2,25,26)(H,28,29)