(2S)-1-(4-ethanoylpiperazin-1-yl)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one

Systemtic Name: (2S)-1-(4-ethanoylpiperazin-1-yl)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Openeye Name: (2S)-1-(4-acetylpiperazin-1-yl)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one CAS Name: (2S)-1-(4-acetyl-1-piperazinyl)-2-methyl-3-(1-piperazin-4-iumylsulfonyl)-1-propanone IUPAC Name: (2S)-1-(4-acetylpiperazin-1-yl)-2-methyl-3-piperazin-4-ium-1-ylsulfonylpropan-1-one Traditional Name: (2S)-1-(4-acetylpiperazino)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Formula: C14H27N4O4S+ MolecularWeight: 347.45358

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CC[NH2+]CC1)C(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C14H26N4O4S/c1-12(11-23(21,22)18-5-3-15-4-6-18)14(20)17-9-7-16(8-10-17)13(2)19/h12,15H,3-11H2,1-2H3/p+1/t12-/m1/s1