(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(1S)-2-indolin-1-yl-1-methyl-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]sulfanylbenzoate Traditional Name: 2-[[(1S)-2-indolin-1-yl-2-keto-1-methyl-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=CC=CC=C3C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCC2=CC=CC=C21)SC3=CC=CC=C3C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C24H27NO4S/c1-16(22(27)25-14-13-17-9-5-7-11-19(17)25)30-20-12-8-6-10-18(20)23(28)29-15-21(26)24(2,3)4/h5-12,16H,13-15H2,1-4H3/t16-/m0/s1