1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-diethyl-5-[(2-nitrophenyl)-(4-nitrophenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H18N4O6S MolecularWeight: 454.45582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3[N+](=O)[O-])C(=O)N(C1=S)CC

Isomeric SMILES

CCN1C(=O)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3[N+](=O)[O-])C(=O)N(C1=S)CC

InChI

InChI=1S/C21H18N4O6S/c1-3-22-19(26)18(20(27)23(4-2)21(22)32)17(13-9-11-14(12-10-13)24(28)29)15-7-5-6-8-16(15)25(30)31/h5-12H,3-4H2,1-2H3