2-[4-(butylcarbamothioyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[4-(butylcarbamothioyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-(butylcarbamothioyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[butylamino(sulfanylidene)methyl]-1-piperazin-1-iumyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-(butylcarbamothioyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[4-(butylthiocarbamoyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Formula: C19H31N4OS+ MolecularWeight: 363.54064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2CC

Isomeric SMILES

CCCCNC(=S)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2CC

InChI

InChI=1S/C19H30N4OS/c1-3-5-10-20-19(25)23-13-11-22(12-14-23)15-18(24)21-17-9-7-6-8-16(17)4-2/h6-9H,3-5,10-15H2,1-2H3,(H,20,25)(H,21,24)/p+1