2-chloranyl-3-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]quinoline

Systemtic Name: 2-chloranyl-3-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]quinoline Openeye Name: 2-chloro-3-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]quinoline CAS Name: 2-chloro-3-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]quinoline IUPAC Name: 2-chloro-3-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]quinoline Traditional Name: 2-chloro-3-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]quinoline Formula: C18H19ClN3O2S2+ MolecularWeight: 408.94536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3N=C2Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3N=C2Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H18ClN3O2S2/c19-18-15(12-14-4-1-2-5-16(14)20-18)13-21-7-9-22(10-8-21)26(23,24)17-6-3-11-25-17/h1-6,11-12H,7-10,13H2/p+1