3-[[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(2-ethoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]amino]propyl-dimethylazanium Traditional Name: dimethyl-[3-[(4-o-phenetylpiperazine-1-carbothioyl)amino]propyl]ammonium Formula: C18H31N4OS+ MolecularWeight: 351.52994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NCCC[NH+](C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NCCC[NH+](C)C

InChI

InChI=1S/C18H30N4OS/c1-4-23-17-9-6-5-8-16(17)21-12-14-22(15-13-21)18(24)19-10-7-11-20(2)3/h5-6,8-9H,4,7,10-15H2,1-3H3,(H,19,24)/p+1