N-[4,5-dimethyl-3-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]thiophen-2-yl]ethanamide

Systemtic Name: N-[4,5-dimethyl-3-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]thiophen-2-yl]ethanamide Openeye Name: N-[3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-4,5-dimethyl-2-thienyl]acetamide CAS Name: N-[4,5-dimethyl-3-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-2-thiophenyl]acetamide IUPAC Name: N-[3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-4,5-dimethylthiophen-2-yl]acetamide Traditional Name: N-[3-[(4-benzylpiperazin-1-ium-1-yl)methyl]-4,5-dimethyl-2-thienyl]acetamide Formula: C20H28N3OS+ MolecularWeight: 358.52082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCN(CC2)CC3=CC=CC=C3)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCN(CC2)CC3=CC=CC=C3)NC(=O)C)C

InChI

InChI=1S/C20H27N3OS/c1-15-16(2)25-20(21-17(3)24)19(15)14-23-11-9-22(10-12-23)13-18-7-5-4-6-8-18/h4-8H,9-14H2,1-3H3,(H,21,24)/p+1