4-chloranyl-5-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-(3-methyl-5-nitro-4-imidazolyl)-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-(3-methyl-5-nitroimidazol-4-yl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazino]-2-phenyl-pyridazin-3-one Formula: C18H18ClN7O3 MolecularWeight: 415.83362

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN7O3/c1-22-12-20-16(26(28)29)17(22)24-9-7-23(8-10-24)14-11-21-25(18(27)15(14)19)13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3