2-methylpropyl 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hexoxy]benzoate

Systemtic Name: 2-methylpropyl 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hexoxy]benzoate Openeye Name: isobutyl 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hexoxy]benzoate CAS Name: 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)thio]hexoxy]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hexoxy]benzoate Traditional Name: 4-[6-[(4,5-diphenyl-1H-imidazol-2-yl)thio]hexoxy]benzoic acid isobutyl ester Formula: C32H36N2O3S MolecularWeight: 528.70484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)OCCCCCCSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)OCCCCCCSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H36N2O3S/c1-24(2)23-37-31(35)27-17-19-28(20-18-27)36-21-11-3-4-12-22-38-32-33-29(25-13-7-5-8-14-25)30(34-32)26-15-9-6-10-16-26/h5-10,13-20,24H,3-4,11-12,21-23H2,1-2H3,(H,33,34)