3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-(thiophen-2-ylmethyl)benzenesulfonamide

Systemtic Name: 3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: 3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-(2-thienylmethyl)benzenesulfonamide CAS Name: 3-[[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: 3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: 3-(4-p-anisylpiperazin-4-ium-1-carbonyl)-N-(2-thenyl)benzenesulfonamide Formula: C24H28N3O4S2+ MolecularWeight: 486.62682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

InChI

InChI=1S/C24H27N3O4S2/c1-31-21-9-7-19(8-10-21)18-26-11-13-27(14-12-26)24(28)20-4-2-6-23(16-20)33(29,30)25-17-22-5-3-15-32-22/h2-10,15-16,25H,11-14,17-18H2,1H3/p+1