3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3S)-tetrahydrothiophen-3-yl]ammonium CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)propyl-[(3S)-3-thiolanyl]ammonium IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3S)-tetrahydrothiophen-3-yl]ammonium Formula: C12H27N3S+2 MolecularWeight: 245.42788

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC[NH2+]C2CCSC2

Isomeric SMILES

C[NH+]1CCN(CC1)CCC[NH2+][C@H]2CCSC2

InChI

InChI=1S/C12H25N3S/c1-14-6-8-15(9-7-14)5-2-4-13-12-3-10-16-11-12/h12-13H,2-11H2,1H3/p+2/t12-/m0/s1