[2-[(3R)-3-methyl-2-oxidanylidene-1,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate

Systemtic Name: [2-[(3R)-3-methyl-2-oxidanylidene-1,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate Openeye Name: [2-[(3R)-3-methyl-2-oxo-indolin-5-yl]-2-oxo-ethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate CAS Name: 3-[(3,4-dimethylphenyl)thio]propanoic acid [2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] ester IUPAC Name: [2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] 3-(3,4-dimethylphenyl)sulfanylpropanoate Traditional Name: 3-[(3,4-dimethylphenyl)thio]propionic acid [2-keto-2-[(3R)-2-keto-3-methyl-indolin-5-yl]ethyl] ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=CC(=C2)C(=O)COC(=O)CCSC3=CC(=C(C=C3)C)C)NC1=O

Isomeric SMILES

C[C@@H]1C2=C(C=CC(=C2)C(=O)COC(=O)CCSC3=CC(=C(C=C3)C)C)NC1=O

InChI

InChI=1S/C22H23NO4S/c1-13-4-6-17(10-14(13)2)28-9-8-21(25)27-12-20(24)16-5-7-19-18(11-16)15(3)22(26)23-19/h4-7,10-11,15H,8-9,12H2,1-3H3,(H,23,26)/t15-/m1/s1