1,3-dimethyl-6-[[2-nitro-2-[(4-pyridin-3-ylcarbonylphenyl)amino]ethyl]amino]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-[[2-nitro-2-[(4-pyridin-3-ylcarbonylphenyl)amino]ethyl]amino]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-[[2-nitro-2-[4-(pyridine-3-carbonyl)anilino]ethyl]amino]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-6-[[2-nitro-2-[4-[oxo(3-pyridinyl)methyl]anilino]ethyl]amino]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-6-[[2-nitro-2-[4-(pyridine-3-carbonyl)anilino]ethyl]amino]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-6-[[2-(4-nicotinoylanilino)-2-nitro-ethyl]amino]pyrimidine-2,4-quinone Formula: C20H20N6O5 MolecularWeight: 424.41

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NCC(NC2=CC=C(C=C2)C(=O)C3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NCC(NC2=CC=C(C=C2)C(=O)C3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O5/c1-24-16(10-18(27)25(2)20(24)29)22-12-17(26(30)31)23-15-7-5-13(6-8-15)19(28)14-4-3-9-21-11-14/h3-11,17,22-23H,12H2,1-2H3