N-[2-[5-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylthiophen-2-yl]ethyl]methanesulfonamide

Systemtic Name: N-[2-[5-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylthiophen-2-yl]ethyl]methanesulfonamide Openeye Name: N-[2-[5-(4-benzylpiperazin-4-ium-1-carbonyl)-2-thienyl]ethyl]methanesulfonamide CAS Name: N-[2-[5-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-2-thiophenyl]ethyl]methanesulfonamide IUPAC Name: N-[2-[5-(4-benzylpiperazin-4-ium-1-carbonyl)thiophen-2-yl]ethyl]methanesulfonamide Traditional Name: N-[2-[5-(4-benzylpiperazin-4-ium-1-carbonyl)-2-thienyl]ethyl]methanesulfonamide Formula: C19H26N3O3S2+ MolecularWeight: 408.55804

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O3S2/c1-27(24,25)20-10-9-17-7-8-18(26-17)19(23)22-13-11-21(12-14-22)15-16-5-3-2-4-6-16/h2-8,20H,9-15H2,1H3/p+1