3-(4-ethylpiperazin-4-ium-1-yl)-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)-1,2-benzothiazole 1,1-dioxide Openeye Name: 3-(4-ethylpiperazin-4-ium-1-yl)-1,2-benzothiazole 1,1-dioxide CAS Name: 3-(4-ethyl-1-piperazin-4-iumyl)-1,2-benzothiazole 1,1-dioxide IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-yl)-1,2-benzothiazole 1,1-dioxide Traditional Name: 3-(4-ethylpiperazin-4-ium-1-yl)-1,2-benzothiazole 1,1-dioxide Formula: C13H18N3O2S+ MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C13H17N3O2S/c1-2-15-7-9-16(10-8-15)13-11-5-3-4-6-12(11)19(17,18)14-13/h3-6H,2,7-10H2,1H3/p+1