2-methyl-2-piperazin-4-ium-1-yl-propanethioamide

Systemtic Name: 2-methyl-2-piperazin-4-ium-1-yl-propanethioamide Openeye Name: 2-methyl-2-piperazin-4-ium-1-yl-propanethioamide CAS Name: 2-methyl-2-(1-piperazin-4-iumyl)propanethioamide IUPAC Name: 2-methyl-2-piperazin-4-ium-1-ylpropanethioamide Traditional Name: 2-methyl-2-piperazin-4-ium-1-yl-thiopropionamide Formula: C8H18N3S+ MolecularWeight: 188.31362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=S)N)N1CC[NH2+]CC1

Isomeric SMILES

CC(C)(C(=S)N)N1CC[NH2+]CC1

InChI

InChI=1S/C8H17N3S/c1-8(2,7(9)12)11-5-3-10-4-6-11/h10H,3-6H2,1-2H3,(H2,9,12)/p+1