[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 2-indan-5-ylsulfanylacetate CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)acetic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetate Traditional Name: 2-(indan-5-ylthio)acetic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2)C

InChI

InChI=1S/C21H23NO3S/c1-14-8-15(2)10-18(9-14)22-20(23)12-25-21(24)13-26-19-7-6-16-4-3-5-17(16)11-19/h6-11H,3-5,12-13H2,1-2H3,(H,22,23)