1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-(1-methyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-(1-methyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-(1-methyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]urea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[(1-methyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]urea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-(1-methyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]urea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[(1-methyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]urea Formula: C27H22F6N4OS MolecularWeight: 564.545199

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1SCCNC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(N=C1SCCNC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H22F6N4OS/c1-37-23(18-10-6-3-7-11-18)22(17-8-4-2-5-9-17)36-25(37)39-13-12-34-24(38)35-21-15-19(26(28,29)30)14-20(16-21)27(31,32)33/h2-11,14-16H,12-13H2,1H3,(H2,34,35,38)