1-(4-ethylphenyl)-3-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]urea

Systemtic Name: 1-(4-ethylphenyl)-3-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]urea Openeye Name: 1-(4-ethylphenyl)-3-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]urea CAS Name: 1-(4-ethylphenyl)-3-[4-[(1,4,5-triphenyl-2-imidazolyl)thio]butyl]urea IUPAC Name: 1-(4-ethylphenyl)-3-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]urea Traditional Name: 1-(4-ethylphenyl)-3-[4-[(1,4,5-triphenylimidazol-2-yl)thio]butyl]urea Formula: C34H34N4OS MolecularWeight: 546.72496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCCCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCCCCSC2=NC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H34N4OS/c1-2-26-20-22-29(23-21-26)36-33(39)35-24-12-13-25-40-34-37-31(27-14-6-3-7-15-27)32(28-16-8-4-9-17-28)38(34)30-18-10-5-11-19-30/h3-11,14-23H,2,12-13,24-25H2,1H3,(H2,35,36,39)