(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(2S)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(2S)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(1S)-1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]sulfanylbenzoate CAS Name: 2-[[(2S)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(2S)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]sulfanylbenzoate Traditional Name: 2-[[(1S)-2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=CC=CC=C3C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N1CC(=O)NC2=CC=CC=C21)SC3=CC=CC=C3C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C24H26N2O5S/c1-15(22(29)26-13-21(28)25-17-10-6-7-11-18(17)26)32-19-12-8-5-9-16(19)23(30)31-14-20(27)24(2,3)4/h5-12,15H,13-14H2,1-4H3,(H,25,28)/t15-/m0/s1