1-(1-adamantyl)-3-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea Openeye Name: 1-(1-adamantyl)-3-[2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea CAS Name: 1-(1-adamantyl)-3-[2-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]urea IUPAC Name: 1-(1-adamantyl)-3-[2-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]urea Traditional Name: 1-(1-adamantyl)-3-[2-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]urea Formula: C30H36N4OS MolecularWeight: 500.69804

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCN1C(=C(N=C1SCCNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H36N4OS/c1-2-34-27(25-11-7-4-8-12-25)26(24-9-5-3-6-10-24)32-29(34)36-14-13-31-28(35)33-30-18-21-15-22(19-30)17-23(16-21)20-30/h3-12,21-23H,2,13-20H2,1H3,(H2,31,33,35)