1-cyclohexyl-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylamino]thiourea Openeye Name: 1-cyclohexyl-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylamino]thiourea CAS Name: 1-cyclohexyl-3-[[3-(4-methyl-1-piperazine-1,4-diiumyl)-1-oxopropyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylamino]thiourea Traditional Name: 1-cyclohexyl-3-[3-(4-methylpiperazine-1,4-diium-1-yl)propanoylamino]thiourea Formula: C15H31N5OS+2 MolecularWeight: 329.50454

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCC(=O)NNC(=S)NC2CCCCC2

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCC(=O)NNC(=S)NC2CCCCC2

InChI

InChI=1S/C15H29N5OS/c1-19-9-11-20(12-10-19)8-7-14(21)17-18-15(22)16-13-5-3-2-4-6-13/h13H,2-12H2,1H3,(H,17,21)(H2,16,18,22)/p+2