2-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-5-(phenylmethylidene)imidazol-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)-5-(phenylmethylidene)imidazol-4-one Openeye Name: 5-benzylidene-2-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazol-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-(4-fluorophenyl)-5-(phenylmethylene)-4-imidazolone IUPAC Name: 5-benzylidene-2-[(4-tert-butylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazol-4-one Traditional Name: 5-benzal-2-[(4-tert-butylbenzyl)thio]-3-(4-fluorophenyl)-2-imidazolin-4-one Formula: C27H25FN2OS MolecularWeight: 444.563603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=CC3=CC=CC=C3)C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=CC3=CC=CC=C3)C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C27H25FN2OS/c1-27(2,3)21-11-9-20(10-12-21)18-32-26-29-24(17-19-7-5-4-6-8-19)25(31)30(26)23-15-13-22(28)14-16-23/h4-17H,18H2,1-3H3