[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 4-indan-5-yl-4-oxo-butanoate CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylanilino)-2-oxoethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoate Traditional Name: 4-indan-5-yl-4-keto-butyric acid [2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)COC(=O)CCC(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)COC(=O)CCC(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C22H23NO4S/c1-28-20-8-3-2-7-18(20)23-21(25)14-27-22(26)12-11-19(24)17-10-9-15-5-4-6-16(15)13-17/h2-3,7-10,13H,4-6,11-12,14H2,1H3,(H,23,25)