4-propan-2-ylpiperazin-4-ium-1-carbothioamide

Systemtic Name: 4-propan-2-ylpiperazin-4-ium-1-carbothioamide Openeye Name: 4-isopropylpiperazin-4-ium-1-carbothioamide CAS Name: 4-propan-2-yl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-propan-2-ylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-isopropylpiperazin-4-ium-1-carbothioamide Formula: C8H18N3S+ MolecularWeight: 188.31362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H17N3S/c1-7(2)10-3-5-11(6-4-10)8(9)12/h7H,3-6H2,1-2H3,(H2,9,12)/p+1