1-(4-ethylpiperazin-4-ium-1-yl)cyclohexane-1-carbothioamide

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)cyclohexane-1-carbothioamide Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)cyclohexanecarbothioamide CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-1-cyclohexanecarbothioamide IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)cyclohexane-1-carbothioamide Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)cyclohexanecarbothioamide Formula: C13H26N3S+ MolecularWeight: 256.43064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2(CCCCC2)C(=S)N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2(CCCCC2)C(=S)N

InChI

InChI=1S/C13H25N3S/c1-2-15-8-10-16(11-9-15)13(12(14)17)6-4-3-5-7-13/h2-11H2,1H3,(H2,14,17)/p+1