3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanoylamino]benzoic acid

Systemtic Name: 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanoylamino]benzoic acid Openeye Name: 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanoylamino]benzoic acid CAS Name: 3-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanoylamino]benzoic acid Traditional Name: 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]butanoylamino]benzoic acid Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C(=O)O)SC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C(=O)O)SC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-2-21(24(30)27-20-15-9-14-19(16-20)25(31)32)33-26-28-22(17-10-5-3-6-11-17)23(29-26)18-12-7-4-8-13-18/h3-16,21H,2H2,1H3,(H,27,30)(H,28,29)(H,31,32)