2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-phenoxyphenyl)butanamide Openeye Name: 2-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-phenoxyphenyl)butanamide CAS Name: 2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]thio]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 2-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-phenoxyphenyl)butanamide Traditional Name: 2-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]thio]-N-(4-phenoxyphenyl)butyramide Formula: C33H31N3O2S MolecularWeight: 533.68314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC(=C(N3)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC(=C(N3)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C33H31N3O2S/c1-4-29(32(37)34-26-18-20-28(21-19-26)38-27-8-6-5-7-9-27)39-33-35-30(24-14-10-22(2)11-15-24)31(36-33)25-16-12-23(3)13-17-25/h5-21,29H,4H2,1-3H3,(H,34,37)(H,35,36)