6-methyl-3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonyl-1-(2-nitrophenyl)pyridazin-4-one

Systemtic Name: 6-methyl-3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonyl-1-(2-nitrophenyl)pyridazin-4-one Openeye Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]-6-methyl-1-(2-nitrophenyl)pyridazin-4-one CAS Name: 6-methyl-3-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-oxomethyl]-1-(2-nitrophenyl)-4-pyridazinone IUPAC Name: 6-methyl-3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]-1-(2-nitrophenyl)pyridazin-4-one Traditional Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]-6-methyl-1-(2-nitrophenyl)pyridazin-4-one Formula: C24H27N7O4 MolecularWeight: 477.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C24H27N7O4/c1-15(2)23-25-16(3)13-21(26-23)28-9-11-29(12-10-28)24(33)22-20(32)14-17(4)30(27-22)18-7-5-6-8-19(18)31(34)35/h5-8,13-15H,9-12H2,1-4H3