3-[[4-(4-hydroxyphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(4-hydroxyphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(4-hydroxyphenyl)piperazine-1-carbothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(4-hydroxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(4-hydroxyphenyl)piperazine-1-carbothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-(4-hydroxyphenyl)piperazine-1-carbothioyl]amino]propyl-dimethyl-ammonium Formula: C16H27N4OS+ MolecularWeight: 323.47678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)O

Isomeric SMILES

C[NH+](C)CCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)O

InChI

InChI=1S/C16H26N4OS/c1-18(2)9-3-8-17-16(22)20-12-10-19(11-13-20)14-4-6-15(21)7-5-14/h4-7,21H,3,8-13H2,1-2H3,(H,17,22)/p+1