dimethyl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)carbothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)carbothioylamino]propyl]azanium Openeye Name: dimethyl-[3-[(4-pyrimidin-2-ylpiperazine-1-carbothioyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[[[4-(2-pyrimidinyl)-1-piperazinyl]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(4-pyrimidin-2-ylpiperazine-1-carbothioyl)amino]propyl]azanium Traditional Name: dimethyl-[3-[[4-(2-pyrimidyl)piperazine-1-carbothioyl]amino]propyl]ammonium Formula: C14H25N6S+ MolecularWeight: 309.4535

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N1CCN(CC1)C2=NC=CC=N2

Isomeric SMILES

C[NH+](C)CCCNC(=S)N1CCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C14H24N6S/c1-18(2)8-4-7-17-14(21)20-11-9-19(10-12-20)13-15-5-3-6-16-13/h3,5-6H,4,7-12H2,1-2H3,(H,17,21)/p+1