4-bromanyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzamide

Systemtic Name: 4-bromanyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzamide Openeye Name: 4-bromo-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzamide CAS Name: 4-bromo-N-[4-[(1,4,5-triphenyl-2-imidazolyl)thio]butyl]benzamide IUPAC Name: 4-bromo-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]benzamide Traditional Name: 4-bromo-N-[4-[(1,4,5-triphenylimidazol-2-yl)thio]butyl]benzamide Formula: C32H28BrN3OS MolecularWeight: 582.55322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)SCCCCNC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H28BrN3OS/c33-27-20-18-26(19-21-27)31(37)34-22-10-11-23-38-32-35-29(24-12-4-1-5-13-24)30(25-14-6-2-7-15-25)36(32)28-16-8-3-9-17-28/h1-9,12-21H,10-11,22-23H2,(H,34,37)