ethyl 2-[2-[(4-methylphenyl)methylsulfanyl]-4,5-diphenyl-imidazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(4-methylphenyl)methylsulfanyl]-4,5-diphenyl-imidazol-1-yl]ethanoate Openeye Name: ethyl 2-[4,5-diphenyl-2-(p-tolylmethylsulfanyl)imidazol-1-yl]acetate CAS Name: 2-[2-[(4-methylphenyl)methylthio]-4,5-diphenyl-1-imidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-methylphenyl)methylsulfanyl]-4,5-diphenylimidazol-1-yl]acetate Traditional Name: 2-[2-[(4-methylbenzyl)thio]-4,5-diphenyl-imidazol-1-yl]acetic acid ethyl ester Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(N=C1SCC2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1C(=C(N=C1SCC2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O2S/c1-3-31-24(30)18-29-26(23-12-8-5-9-13-23)25(22-10-6-4-7-11-22)28-27(29)32-19-21-16-14-20(2)15-17-21/h4-17H,3,18-19H2,1-2H3