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

Systemtic Name: 2-methylpropyl 2-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: isobutyl 2-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]acetyl]amino]benzoic acid isobutyl ester Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O3S/c1-19(2)17-34-27(33)22-15-9-10-16-23(22)29-24(32)18-35-28-30-25(20-11-5-3-6-12-20)26(31-28)21-13-7-4-8-14-21/h3-16,19H,17-18H2,1-2H3,(H,29,32)(H,30,31)