6-[[3-(1H-imidazol-5-yl)propylhydrazinylidene]methylidene]-4-(3-nitrophenyl)-5-piperazin-1-yl-1,2-diazinan-3-one

Systemtic Name: 6-[[3-(1H-imidazol-5-yl)propylhydrazinylidene]methylidene]-4-(3-nitrophenyl)-5-piperazin-1-yl-1,2-diazinan-3-one Openeye Name: 6-[[3-(1H-imidazol-5-yl)propylhydrazono]methylene]-4-(3-nitrophenyl)-5-piperazin-1-yl-hexahydropyridazin-3-one CAS Name: 6-[[3-(1H-imidazol-5-yl)propylhydrazinylidene]methylidene]-4-(3-nitrophenyl)-5-(1-piperazinyl)-3-diazinanone IUPAC Name: 6-[[3-(1H-imidazol-5-yl)propylhydrazinylidene]methylidene]-4-(3-nitrophenyl)-5-piperazin-1-yldiazinan-3-one Traditional Name: 6-[[3-(1H-imidazol-5-yl)propylhydrazono]methylene]-4-(3-nitrophenyl)-5-piperazino-hexahydropyridazin-3-one Formula: C21H27N9O3 MolecularWeight: 453.49758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2C(C(=O)NNC2=C=NNCCCC3=CN=CN3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2C(C(=O)NNC2=C=NNCCCC3=CN=CN3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H27N9O3/c31-21-19(15-3-1-5-17(11-15)30(32)33)20(29-9-7-22-8-10-29)18(27-28-21)13-26-25-6-2-4-16-12-23-14-24-16/h1,3,5,11-12,14,19-20,22,25,27H,2,4,6-10H2,(H,23,24)(H,28,31)