N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1,4,5-triphenylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1,4,5-triphenylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(1,4,5-triphenylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[(1,4,5-triphenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(1,4,5-triphenylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[(1,4,5-triphenylimidazol-2-yl)thio]acetamide Formula: C29H21ClFN3OS MolecularWeight: 514.012943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)SCC(=O)NC3=CC(=C(C=C3)F)Cl)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)SCC(=O)NC3=CC(=C(C=C3)F)Cl)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H21ClFN3OS/c30-24-18-22(16-17-25(24)31)32-26(35)19-36-29-33-27(20-10-4-1-5-11-20)28(21-12-6-2-7-13-21)34(29)23-14-8-3-9-15-23/h1-18H,19H2,(H,32,35)