1-butylsulfonyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium

Systemtic Name: 1-butylsulfonyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-butylsulfonyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium CAS Name: 1-butylsulfonyl-4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-butylsulfonyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-butylsulfonyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium Formula: C15H29N4O2S+ MolecularWeight: 329.48136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CC[NH+](CC1)CC2=C(N(N=C2C)C)C

Isomeric SMILES

CCCCS(=O)(=O)N1CC[NH+](CC1)CC2=C(N(N=C2C)C)C

InChI

InChI=1S/C15H28N4O2S/c1-5-6-11-22(20,21)19-9-7-18(8-10-19)12-15-13(2)16-17(4)14(15)3/h5-12H2,1-4H3/p+1