2-[2-[3-(2,2-diphenylethanoylamino)propylsulfanyl]benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[3-(2,2-diphenylethanoylamino)propylsulfanyl]benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[2-[3-[(2,2-diphenylacetyl)amino]propylsulfanyl]benzimidazol-1-yl]acetic acid CAS Name: 2-[2-[3-[(1-oxo-2,2-diphenylethyl)amino]propylthio]-1-benzimidazolyl]acetic acid IUPAC Name: 2-[2-[3-[(2,2-diphenylacetyl)amino]propylsulfanyl]benzimidazol-1-yl]acetic acid Traditional Name: 2-[2-[3-[(2,2-diphenylacetyl)amino]propylthio]benzimidazol-1-yl]acetic acid Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NCCCSC3=NC4=CC=CC=C4N3CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NCCCSC3=NC4=CC=CC=C4N3CC(=O)O

InChI

InChI=1S/C26H25N3O3S/c30-23(31)18-29-22-15-8-7-14-21(22)28-26(29)33-17-9-16-27-25(32)24(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-15,24H,9,16-18H2,(H,27,32)(H,30,31)