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

Systemtic Name: ethyl 2-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-diphenyl-imidazol-1-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-diphenyl-imidazol-1-yl]acetate CAS Name: 2-[2-[(4-nitrophenyl)methylthio]-4,5-diphenyl-1-imidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-nitrophenyl)methylsulfanyl]-4,5-diphenylimidazol-1-yl]acetate Traditional Name: 2-[2-[(4-nitrobenzyl)thio]-4,5-diphenyl-imidazol-1-yl]acetic acid ethyl ester Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(N=C1SCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1C(=C(N=C1SCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O4S/c1-2-33-23(30)17-28-25(21-11-7-4-8-12-21)24(20-9-5-3-6-10-20)27-26(28)34-18-19-13-15-22(16-14-19)29(31)32/h3-16H,2,17-18H2,1H3