N-methyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]-N-(thiophen-3-ylmethyl)ethanamide

Systemtic Name: N-methyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]-N-(thiophen-3-ylmethyl)ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-methyl-N-(3-thienylmethyl)acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-methyl-N-(3-thiophenylmethyl)acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-methyl-N-(thiophen-3-ylmethyl)acetamide Traditional Name: 2-(4-besylpiperazin-1-ium-1-yl)-N-methyl-N-(3-thenyl)acetamide Formula: C18H24N3O3S2+ MolecularWeight: 394.53146

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3O3S2/c1-19(13-16-7-12-25-15-16)18(22)14-20-8-10-21(11-9-20)26(23,24)17-5-3-2-4-6-17/h2-7,12,15H,8-11,13-14H2,1H3/p+1