5-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 5-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-2-sulfanylidene-imidazolidin-4-one Openeye Name: 5-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylene]-2-thioxo-imidazolidin-4-one CAS Name: 5-[[2,5-dimethyl-1-(4-nitrophenyl)-3-pyrrolyl]methylidene]-2-sulfanylidene-4-imidazolidinone IUPAC Name: 5-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-2-sulfanylideneimidazolidin-4-one Traditional Name: 5-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylene]-2-thioxo-4-imidazolidinone Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C=C3C(=O)NC(=S)N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C=C3C(=O)NC(=S)N3

InChI

InChI=1S/C16H14N4O3S/c1-9-7-11(8-14-15(21)18-16(24)17-14)10(2)19(9)12-3-5-13(6-4-12)20(22)23/h3-8H,1-2H3,(H2,17,18,21,24)