1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptyl-3-octyl-urea

Systemtic Name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptyl-3-octyl-urea Openeye Name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptyl-3-octyl-urea CAS Name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)thio]pentyl]-1-heptyl-3-octylurea IUPAC Name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptyl-3-octylurea Traditional Name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)thio]pentyl]-1-heptyl-3-octyl-urea Formula: C36H54N4OS MolecularWeight: 590.90516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)N(CCCCCCC)CCCCCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCNC(=O)N(CCCCCCC)CCCCCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C36H54N4OS/c1-3-5-7-9-10-19-27-37-36(41)40(28-20-11-8-6-4-2)29-21-14-22-30-42-35-38-33(31-23-15-12-16-24-31)34(39-35)32-25-17-13-18-26-32/h12-13,15-18,23-26H,3-11,14,19-22,27-30H2,1-2H3,(H,37,41)(H,38,39)