1-(4-methylpiperazin-4-ium-1-yl)-2-phthalazin-1-ylsulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-phthalazin-1-ylsulfanyl-ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-phthalazin-1-ylsulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-(1-phthalazinylthio)ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-phthalazin-1-ylsulfanylethanone Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(phthalazin-1-ylthio)ethanone Formula: C15H19N4OS+ MolecularWeight: 303.40256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CSC2=NN=CC3=CC=CC=C32

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CSC2=NN=CC3=CC=CC=C32

InChI

InChI=1S/C15H18N4OS/c1-18-6-8-19(9-7-18)14(20)11-21-15-13-5-3-2-4-12(13)10-16-17-15/h2-5,10H,6-9,11H2,1H3/p+1