[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)COC(=O)C2=C3CCCCC3=NC4=CC=CC=C42

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)COC(=O)C2=C3CCCCC3=NC4=CC=CC=C42

InChI

InChI=1S/C23H22N2O3S/c1-29-16-8-6-7-15(13-16)24-21(26)14-28-23(27)22-17-9-2-4-11-19(17)25-20-12-5-3-10-18(20)22/h2,4,6-9,11,13H,3,5,10,12,14H2,1H3,(H,24,26)