5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylene]-3-[2-oxo-2-(1-piperidyl)ethyl]thiazolidine-2,4-dione CAS Name: 5-[[1-(4-nitrophenyl)-2-pyrrolyl]methylidene]-3-[2-oxo-2-(1-piperidinyl)ethyl]thiazolidine-2,4-dione IUPAC Name: 5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylidene]-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazolidine-2,4-dione Traditional Name: 3-(2-keto-2-piperidino-ethyl)-5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylene]thiazolidine-2,4-quinone Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)[N+](=O)[O-])SC2=O

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)[N+](=O)[O-])SC2=O

InChI

InChI=1S/C21H20N4O5S/c26-19(22-10-2-1-3-11-22)14-24-20(27)18(31-21(24)28)13-17-5-4-12-23(17)15-6-8-16(9-7-15)25(29)30/h4-9,12-13H,1-3,10-11,14H2