1-methyl-3-[3-[4-[3-(methylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea

Systemtic Name: 1-methyl-3-[3-[4-[3-(methylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Openeye Name: 1-methyl-3-[3-[4-[3-(methylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea CAS Name: 1-methyl-3-[3-[4-[3-[[methylamino(sulfanylidene)methyl]amino]propyl]-1-piperazin-1-iumyl]propyl]thiourea IUPAC Name: 1-methyl-3-[3-[4-[3-(methylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Traditional Name: 1-methyl-3-[3-[4-[3-(methylthiocarbamoylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Formula: C14H31N6S2+ MolecularWeight: 347.56614

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCC[NH+]1CCN(CC1)CCCNC(=S)NC

Isomeric SMILES

CNC(=S)NCCC[NH+]1CCN(CC1)CCCNC(=S)NC

InChI

InChI=1S/C14H30N6S2/c1-15-13(21)17-5-3-7-19-9-11-20(12-10-19)8-4-6-18-14(22)16-2/h3-12H2,1-2H3,(H2,15,17,21)(H2,16,18,22)/p+1