2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(4-fluorophenyl)-5-(phenylmethylidene)imidazol-4-one

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(4-fluorophenyl)-5-(phenylmethylidene)imidazol-4-one Openeye Name: 5-benzylidene-2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazol-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-(4-fluorophenyl)-5-(phenylmethylene)-4-imidazolone IUPAC Name: 5-benzylidene-2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazol-4-one Traditional Name: 5-benzal-2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-(4-fluorophenyl)-2-imidazolin-4-one Formula: C29H29FN2OS MolecularWeight: 472.616763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC(=CC3=CC=CC=C3)C(=O)N2C4=CC=C(C=C4)F)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC(=CC3=CC=CC=C3)C(=O)N2C4=CC=C(C=C4)F)C)C(C)(C)C

InChI

InChI=1S/C29H29FN2OS/c1-19-15-22(29(3,4)5)16-20(2)25(19)18-34-28-31-26(17-21-9-7-6-8-10-21)27(33)32(28)24-13-11-23(30)12-14-24/h6-17H,18H2,1-5H3