3-[3-[3-(1H-imidazol-2-ylamino)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid

Systemtic Name: 3-[3-[3-(1H-imidazol-2-ylamino)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid Openeye Name: 3-[3-[3-(1H-imidazol-2-ylamino)phenyl]phenyl]sulfonyl-3-phenyl-propanoic acid CAS Name: 3-[3-[3-(1H-imidazol-2-ylamino)phenyl]phenyl]sulfonyl-3-phenylpropanoic acid IUPAC Name: 3-[3-[3-(1H-imidazol-2-ylamino)phenyl]phenyl]sulfonyl-3-phenylpropanoic acid Traditional Name: 3-[3-[3-(1H-imidazol-2-ylamino)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)NC4=NC=CN4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)S(=O)(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)NC4=NC=CN4

InChI

InChI=1S/C24H21N3O4S/c28-23(29)16-22(17-6-2-1-3-7-17)32(30,31)21-11-5-9-19(15-21)18-8-4-10-20(14-18)27-24-25-12-13-26-24/h1-15,22H,16H2,(H,28,29)(H2,25,26,27)