2-methylpropyl 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-2-oxidanyl-propoxy]benzoate

Systemtic Name: 2-methylpropyl 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-2-oxidanyl-propoxy]benzoate Openeye Name: isobutyl 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-2-hydroxy-propoxy]benzoate CAS Name: 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-2-hydroxypropoxy]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-2-hydroxypropoxy]benzoate Traditional Name: 4-[(2R)-3-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-2-hydroxy-propoxy]benzoic acid isobutyl ester Formula: C29H30N2O4S MolecularWeight: 502.6245

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)OCC(CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)OC[C@H](CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C29H30N2O4S/c1-20(2)17-35-28(33)23-13-15-25(16-14-23)34-18-24(32)19-36-29-30-26(21-9-5-3-6-10-21)27(31-29)22-11-7-4-8-12-22/h3-16,20,24,32H,17-19H2,1-2H3,(H,30,31)/t24-/m1/s1