[(2R)-1-oxidanylidene-1-[2-(phenylcarbonyl)hydrazinyl]propan-2-yl] 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[2-(phenylcarbonyl)hydrazinyl]propan-2-yl] 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: [(1R)-2-(2-benzoylhydrazino)-1-methyl-2-oxo-ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [(2R)-1-(benzoylhydrazo)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-benzoylhydrazinyl)-1-oxopropan-2-yl] 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [(1R)-2-(N'-benzoylhydrazino)-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)OC(C)C(=O)NNC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)O[C@H](C)C(=O)NNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-13-9-10-14(2)17(11-13)27-12-18(23)26-15(3)19(24)21-22-20(25)16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,21,24)(H,22,25)/t15-/m1/s1