2-[[1-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]benzimidazol-2-yl]amino]ethanol

Systemtic Name: 2-[[1-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]benzimidazol-2-yl]amino]ethanol Openeye Name: 2-[[1-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]benzimidazol-2-yl]amino]ethanol CAS Name: 2-[[1-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]-2-benzimidazolyl]amino]ethanol IUPAC Name: 2-[[1-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]benzimidazol-2-yl]amino]ethanol Traditional Name: 2-[[1-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]benzimidazol-2-yl]amino]ethanol Formula: C18H24N5O3S2+ MolecularWeight: 422.54486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C3=CC=CC=C3N=C2NCCO)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CN2C3=CC=CC=C3N=C2NCCO)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H23N5O3S2/c24-12-7-19-18-20-15-4-1-2-5-16(15)23(18)14-21-8-10-22(11-9-21)28(25,26)17-6-3-13-27-17/h1-6,13,24H,7-12,14H2,(H,19,20)/p+1