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

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)NCCSC4=CC=CC=C4

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)NCCSC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3S/c27-22(25-14-15-30-17-8-2-1-3-9-17)16-29-24(28)23-18-10-4-6-12-20(18)26-21-13-7-5-11-19(21)23/h1-4,6,8-10,12H,5,7,11,13-16H2,(H,25,27)