1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-5-yl]-4-methyl-piperazine-2,6-dione

Systemtic Name: 1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-5-yl]-4-methyl-piperazine-2,6-dione Openeye Name: 1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-5-yl]-4-methyl-piperazine-2,6-dione CAS Name: 1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-5-pyrimidinyl]-4-methylpiperazine-2,6-dione IUPAC Name: 1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidin-5-yl]-4-methylpiperazine-2,6-dione Traditional Name: 1-[4-(2,4-dichlorophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidin-5-yl]-4-methyl-piperazine-2,6-quinone Formula: C22H20Cl2N8O4 MolecularWeight: 531.3514

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C(=O)C1)C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CC(=O)N(C(=O)C1)C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20Cl2N8O4/c1-30-11-19(33)31(20(34)12-30)17-10-28-22(29-21(17)15-4-2-13(23)8-16(15)24)26-7-6-25-18-5-3-14(9-27-18)32(35)36/h2-5,8-10H,6-7,11-12H2,1H3,(H,25,27)(H,26,28,29)