N-[(2S)-butan-2-yl]-2-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]piperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide CAS Name: N-[(2S)-butan-2-yl]-2-[4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[(2S)-2-methylpiperidino]sulfonylpiperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide Formula: C16H33N4O3S+ MolecularWeight: 361.52322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)N2CCCCC2C

Isomeric SMILES

CC[C@H](C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)N2CCCC[C@@H]2C

InChI

InChI=1S/C16H32N4O3S/c1-4-14(2)17-16(21)13-18-9-11-19(12-10-18)24(22,23)20-8-6-5-7-15(20)3/h14-15H,4-13H2,1-3H3,(H,17,21)/p+1/t14-,15-/m0/s1