N-[6-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]ethanamide

Systemtic Name: N-[6-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]ethanamide Openeye Name: N-[6-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxo-butyl]sulfanylpyridazin-3-yl]acetamide CAS Name: N-[6-[[4-(4-methyl-1-piperazin-4-iumyl)-4-oxobutyl]thio]-3-pyridazinyl]acetamide IUPAC Name: N-[6-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxobutyl]sulfanylpyridazin-3-yl]acetamide Traditional Name: N-[6-[[4-keto-4-(4-methylpiperazin-4-ium-1-yl)butyl]thio]pyridazin-3-yl]acetamide Formula: C15H24N5O2S+ MolecularWeight: 338.44836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C15H23N5O2S/c1-12(21)16-13-5-6-14(18-17-13)23-11-3-4-15(22)20-9-7-19(2)8-10-20/h5-6H,3-4,7-11H2,1-2H3,(H,16,17,21)/p+1