3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)-6-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(3-nitrophenyl)sulfonylpiperazino]pyridazine Formula: C19H26N7O4S+ MolecularWeight: 448.51924

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H25N7O4S/c1-22-7-9-23(10-8-22)18-5-6-19(21-20-18)24-11-13-25(14-12-24)31(29,30)17-4-2-3-16(15-17)26(27)28/h2-6,15H,7-14H2,1H3/p+1