N,N-dimethyl-2-[4-(2-naphthalen-2-ylsulfanylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(2-naphthalen-2-ylsulfanylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-[2-(2-naphthylsulfanyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[2-(2-naphthalenylthio)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(2-naphthalen-2-ylsulfanylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[2-(2-naphthylthio)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H25N3O2S/c1-21(2)19(24)14-22-9-11-23(12-10-22)20(25)15-26-18-8-7-16-5-3-4-6-17(16)13-18/h3-8,13H,9-12,14-15H2,1-2H3/p+1