N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperazine-1-carboxamide

Systemtic Name: N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperazine-1-carboxamide Openeye Name: N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperazine-1-carboxamide CAS Name: N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]-1-piperazinecarboxamide IUPAC Name: N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]piperazine-1-carboxamide Traditional Name: N-[3-(1H-imidazol-5-yl)propyl]-4-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperazine-1-carboxamide Formula: C22H28N8O4 MolecularWeight: 468.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C(=O)NCCCC4=CN=CN4)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C(=O)NCCCC4=CN=CN4)[N+](=O)[O-]

InChI

InChI=1S/C22H28N8O4/c1-15-11-20(31)26-27-21(15)16-4-5-18(19(12-16)30(33)34)28-7-9-29(10-8-28)22(32)24-6-2-3-17-13-23-14-25-17/h4-5,12-15H,2-3,6-11H2,1H3,(H,23,25)(H,24,32)(H,26,31)