2-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]propanethioamide

Systemtic Name: 2-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]propanethioamide Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-propanethioamide CAS Name: 2-methyl-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]propanethioamide IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-methylpropanethioamide Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-thiopropionamide Formula: C15H24N3S+ MolecularWeight: 278.43616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=S)N)N1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=S)N)N1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C15H23N3S/c1-15(2,14(16)19)18-10-8-17(9-11-18)12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H2,16,19)/p+1