dimethyl-[3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbothioylamino]propyl]azanium Openeye Name: 3-[[4-[(E)-cinnamyl]piperazin-4-ium-1-carbothioyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioyl]amino]propyl]azanium Traditional Name: 3-[[4-[(E)-cinnamyl]piperazin-4-ium-1-carbothioyl]amino]propyl-dimethyl-ammonium Formula: C19H32N4S+2 MolecularWeight: 348.54918

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N1CC[NH+](CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCCNC(=S)N1CC[NH+](CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C19H30N4S/c1-21(2)12-7-11-20-19(24)23-16-14-22(15-17-23)13-6-10-18-8-4-3-5-9-18/h3-6,8-10H,7,11-17H2,1-2H3,(H,20,24)/p+2/b10-6+