[2-[[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-phenyl-amino]-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-phenyl-amino]-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]anilino)-2-oxo-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]anilino)-2-oxoethyl] ester IUPAC Name: [2-(N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]anilino)-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(N-[(3R)-1,1-diketo-2,3-dihydrothiophen-3-yl]anilino)-2-keto-ethyl] ester Formula: C26H24N2O5S MolecularWeight: 476.54416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N(C4CS(=O)(=O)C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N([C@H]4CS(=O)(=O)C=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H24N2O5S/c29-24(28(18-8-2-1-3-9-18)19-14-15-34(31,32)17-19)16-33-26(30)25-20-10-4-6-12-22(20)27-23-13-7-5-11-21(23)25/h1-4,6,8-10,12,14-15,19H,5,7,11,13,16-17H2/t19-/m1/s1