3-[(3-carbamothioylpyridin-2-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-carbamothioylpyridin-2-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(3-carbamothioyl-2-pyridyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(3-carbamothioyl-2-pyridinyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(3-carbamothioylpyridin-2-yl)amino]propyl-dimethylazanium Traditional Name: dimethyl-[3-[(3-thiocarbamoyl-2-pyridyl)amino]propyl]ammonium Formula: C11H19N4S+ MolecularWeight: 239.36036

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(C=CC=N1)C(=S)N

Isomeric SMILES

C[NH+](C)CCCNC1=C(C=CC=N1)C(=S)N

InChI

InChI=1S/C11H18N4S/c1-15(2)8-4-7-14-11-9(10(12)16)5-3-6-13-11/h3,5-6H,4,7-8H2,1-2H3,(H2,12,16)(H,13,14)/p+1