2-[[4-(1-benzothiophen-3-ylmethyl)piperazin-4-ium-1-yl]carbothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-(1-benzothiophen-3-ylmethyl)piperazin-4-ium-1-yl]carbothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(benzothiophen-3-ylmethyl)piperazin-4-ium-1-carbothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-(1-benzothiophen-3-ylmethyl)-1-piperazin-4-iumyl]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(1-benzothiophen-3-ylmethyl)piperazin-4-ium-1-carbothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-(benzothiophen-3-ylmethyl)piperazin-4-ium-1-carbothioyl]amino]ethyl-dimethyl-ammonium Formula: C18H28N4S2+2 MolecularWeight: 364.57172

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)N1CC[NH+](CC1)CC2=CSC3=CC=CC=C32

Isomeric SMILES

C[NH+](C)CCNC(=S)N1CC[NH+](CC1)CC2=CSC3=CC=CC=C32

InChI

InChI=1S/C18H26N4S2/c1-20(2)8-7-19-18(23)22-11-9-21(10-12-22)13-15-14-24-17-6-4-3-5-16(15)17/h3-6,14H,7-13H2,1-2H3,(H,19,23)/p+2