1-(4-methylpiperazin-4-ium-1-yl)-3-(3-methylsulfanylphenyl)urea

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(3-methylsulfanylphenyl)urea Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(3-methylsulfanylphenyl)urea CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-3-[3-(methylthio)phenyl]urea IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-(3-methylsulfanylphenyl)urea Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-3-[3-(methylthio)phenyl]urea Formula: C13H21N4OS+ MolecularWeight: 281.39704

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C13H20N4OS/c1-16-6-8-17(9-7-16)15-13(18)14-11-4-3-5-12(10-11)19-2/h3-5,10H,6-9H2,1-2H3,(H2,14,15,18)/p+1