4-tert-butyl-N-[3-(1,4,5-triphenylimidazol-2-yl)sulfanylpropyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-(1,4,5-triphenylimidazol-2-yl)sulfanylpropyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(1,4,5-triphenylimidazol-2-yl)sulfanylpropyl]benzamide CAS Name: 4-tert-butyl-N-[3-[(1,4,5-triphenyl-2-imidazolyl)thio]propyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(1,4,5-triphenylimidazol-2-yl)sulfanylpropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[(1,4,5-triphenylimidazol-2-yl)thio]propyl]benzamide Formula: C35H35N3OS MolecularWeight: 545.7369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C35H35N3OS/c1-35(2,3)29-22-20-28(21-23-29)33(39)36-24-13-25-40-34-37-31(26-14-7-4-8-15-26)32(27-16-9-5-10-17-27)38(34)30-18-11-6-12-19-30/h4-12,14-23H,13,24-25H2,1-3H3,(H,36,39)