5-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylene]-1-ethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2,5-dimethyl-1-(3-nitrophenyl)-3-pyrrolyl]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]methylene]-1-ethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)[N+](=O)[O-])C)C(=O)NC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)[N+](=O)[O-])C)C(=O)NC1=S

InChI

InChI=1S/C19H18N4O4S/c1-4-21-18(25)16(17(24)20-19(21)28)9-13-8-11(2)22(12(13)3)14-6-5-7-15(10-14)23(26)27/h5-10H,4H2,1-3H3,(H,20,24,28)