5-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methylene]-3-[(3-nitrophenyl)methyl]thiazolidine-2,4-dione CAS Name: 5-[[2,5-dimethyl-1-(3-pyridinyl)-3-pyrrolyl]methylidene]-3-[(3-nitrophenyl)methyl]thiazolidine-2,4-dione IUPAC Name: 5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-3-[(3-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 5-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methylene]-3-(3-nitrobenzyl)thiazolidine-2,4-quinone Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4S/c1-14-9-17(15(2)25(14)19-7-4-8-23-12-19)11-20-21(27)24(22(28)31-20)13-16-5-3-6-18(10-16)26(29)30/h3-12H,13H2,1-2H3