2-[4-(phenylcarbamothioyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-(phenylcarbamothioyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(phenylcarbamothioyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[anilino(sulfanylidene)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(phenylcarbamothioyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(phenylthiocarbamoyl)piperazin-1-ium-1-yl]acetamide Formula: C13H19N4OS+ MolecularWeight: 279.38116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)C(=S)NC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C13H18N4OS/c14-12(18)10-16-6-8-17(9-7-16)13(19)15-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,14,18)(H,15,19)/p+1